2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide

C18H27N3O2 — CID 8913700

IUPAC2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)[C@H](C(=O)N1CCCC1)c1ccccc1
InChIInChI=1S/C18H27N3O2/c1-14(2)19-16(22)13-20(3)17(15-9-5-4-6-10-15)18(23)21-11-7-8-12-21/h4-6,9-10,14,17H,7-8,11-13H2,1-3H3,(H,19,22)/t17-/m0/s1
InChIKeyZFQFONKFOCHNJV-KRWDZBQOSA-N
MW317.43 g/mol
LogP1.81
Rot. Bonds6

About 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide

2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide (PubChem CID 8913700) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide
PubChem CID8913700
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide
SMILESCC(C)NC(=O)CN(C)[C@H](C(=O)N1CCCC1)c1ccccc1
InChIInChI=1S/C18H27N3O2/c1-14(2)19-16(22)13-20(3)17(15-9-5-4-6-10-15)18(23)21-11-7-8-12-21/h4-6,9-10,14,17H,7-8,11-13H2,1-3H3,(H,19,22)/t17-/m0/s1
InChIKeyZFQFONKFOCHNJV-KRWDZBQOSA-N
XLogP1.81
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-2-[methyl-[(1S)-2-oxo-1-phenyl-2-piperidin-1-ylethyl]amino]acetamide
CID 8910706
N-(2,3-dimethylphenyl)-2-[methyl-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)amino]acetamide
CID 43021751
(2S)-N-(methylcarbamoyl)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2-phenylacetamide
CID 8912953
1-(azetidin-1-yl)-2-(dimethylamino)-2-phenylethanone
CID 143781078
2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-2-phenylacetohydrazide
CID 63584319
(2S)-N-(4-fluorophenyl)-2-[methyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-2-phenylacetamide
CID 9049752
2-[methyl-[(1S)-2-morpholin-4-yl-2-oxo-1-phenylethyl]amino]-N-(4-methylphenyl)acetamide
CID 8785626
(2S)-2-[methyl-(2-oxo-2-pyrrolidin-1-ylethyl)amino]-2-phenylacetamide
CID 32616608
N-methyl-N-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)methanesulfonamide
CID 133161882
2-[ethyl(methyl)amino]-1-[4-(2-methylpropyl)piperazin-1-yl]-2-phenylethanone
CID 56509530
N-(4-acetamidophenyl)-2-[ethyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]acetamide
CID 8791437
(2S)-2-[1,3-benzodioxol-5-ylmethyl(methyl)amino]-2-phenyl-1-pyrrolidin-1-ylethanone
CID 8924310

Frequently Asked Questions

What is the IUPAC name of 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide (CID 8913700) is 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide is CC(C)NC(=O)CN(C)[C@H](C(=O)N1CCCC1)c1ccccc1.
What is the InChIKey of 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide?
The InChIKey is ZFQFONKFOCHNJV-KRWDZBQOSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14(2)19-16(22)13-20(3)17(15-9-5-4-6-10-15)18(23)21-11-7-8-12-21/h4-6,9-10,14,17H,7-8,11-13H2,1-3H3,(H,19,22)/t17-/m0/s1.
What are the key properties of 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide?
2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide has a molecular weight of 317.43 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 8913700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).