Name: Name:2,2-dimethyl-1-[2-(thiophen-3-yl)pyrrolidin-1-yl]propan-1-one
Brand: Angene
SKU: AG01BBQM
Rating: 90 (10 reviews)

2,2-dimethyl-1-[2-(thiophen-3-yl)pyrrolidin-1-yl]propan-1-one

CAS No.:

1498742-53-2

Catalog Number:

AG01BBQM

Molecular Formula:

C13H19NOS

Molecular Weight:

237.3611

Catalog Number:

AG01BBQM

Chemical Name:

2,2-dimethyl-1-[2-(thiophen-3-yl)pyrrolidin-1-yl]propan-1-one

CAS Number:

1498742-53-2

Molecular Formula:

C13H19NOS

Molecular Weight:

237.3611

MDL Number:

MFCD20089184

IUPAC Name:

2,2-dimethyl-1-(2-thiophen-3-ylpyrrolidin-1-yl)propan-1-one

InChI:

InChI=1S/C13H19NOS/c1-13(2,3)12(15)14-7-4-5-11(14)10-6-8-16-9-10/h6,8-9,11H,4-5,7H2,1-3H3

InChI Key:

VWDLUSNCEWOCJC-UHFFFAOYSA-N

SMILES:

O=C(C(C)(C)C)N1CCCC1c1cscc1

Complexity:

272

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

237.119g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

237.361g/mol

Monoisotopic Mass:

237.119g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

48.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

2.8