Name: Name:3-(4-amino-3-methylphenoxy)-1-methylpyrrolidin-2-one
Brand: Angene
SKU: AG01BHIW
Rating: 90 (10 reviews)

3-(4-amino-3-methylphenoxy)-1-methylpyrrolidin-2-one

CAS No.:

1343823-13-1

Catalog Number:

AG01BHIW

Molecular Formula:

C12H16N2O2

Molecular Weight:

220.2676

Catalog Number:

AG01BHIW

Chemical Name:

3-(4-amino-3-methylphenoxy)-1-methylpyrrolidin-2-one

CAS Number:

1343823-13-1

Molecular Formula:

C12H16N2O2

Molecular Weight:

220.2676

MDL Number:

MFCD20284701

IUPAC Name:

3-(4-amino-3-methylphenoxy)-1-methylpyrrolidin-2-one

InChI:

InChI=1S/C12H16N2O2/c1-8-7-9(3-4-10(8)13)16-11-5-6-14(2)12(11)15/h3-4,7,11H,5-6,13H2,1-2H3

InChI Key:

CEMVCEDCNFHYKG-UHFFFAOYSA-N

SMILES:

O=C1N(C)CCC1Oc1ccc(c(c1)C)N

Complexity:

270

Compound Is Canonicalized:

Yes

Covalently-Bonded Unit Count:

Defined Atom Stereocenter Count:

Defined Bond Stereocenter Count:

Exact Mass:

220.121g/mol

Formal Charge:

Heavy Atom Count:

Hydrogen Bond Acceptor Count:

Hydrogen Bond Donor Count:

Isotope Atom Count:

Molecular Weight:

220.272g/mol

Monoisotopic Mass:

220.121g/mol

Rotatable Bond Count:

Topological Polar Surface Area:

55.6A^2

Undefined Atom Stereocenter Count:

Undefined Bond Stereocenter Count:

XLogP3:

1.3