Name: Name:4-methyl-4-phenylpyrrolidin-2-one
Brand: Angene
SKU: AG01AFX9
Rating: 90 (10 reviews)

4-methyl-4-phenylpyrrolidin-2-one

CAS No.:

74499-07-3

Catalog Number:

AG01AFX9

Molecular Formula:

C11H13NO

Molecular Weight:

175.2270

Pack Size

Purity

Availability

Location

Price(USD)

Quantity

Product Description

Catalog Number:

AG01AFX9

Chemical Name:

4-methyl-4-phenylpyrrolidin-2-one

CAS Number:

74499-07-3

Molecular Formula:

C11H13NO

Molecular Weight:

175.2270

MDL Number:

MFCD02955556

IUPAC Name:

4-methyl-4-phenylpyrrolidin-2-one

InChI:

InChI=1S/C11H13NO/c1-11(7-10(13)12-8-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,12,13)

InChI Key:

JHXOTRGSEUYRHN-UHFFFAOYSA-N

SMILES:

O=C1NCC(C1)(C)c1ccccc1

Properties

Complexity:

208

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

175.1g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

175.231g/mol

Monoisotopic Mass:

175.1g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

29.1A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.5

Literature

Title	Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.	Bioorganic & medicinal chemistry letters 20101101