(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide

C17H24N2O3 — CID 97311059

IUPAC(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCC[C@H](NC(=O)[C@H]1CCN(C)C(=O)C1)c1ccc(OC)cc1
InChIInChI=1S/C17H24N2O3/c1-4-15(12-5-7-14(22-3)8-6-12)18-17(21)13-9-10-19(2)16(20)11-13/h5-8,13,15H,4,9-11H2,1-3H3,(H,18,21)/t13-,15-/m0/s1
InChIKeyYCKGBRUXIFPMKV-ZFWWWQNUSA-N
MW304.39 g/mol
LogP2.13
Rot. Bonds5

About (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide

(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide (PubChem CID 97311059) has the molecular formula C17H24N2O3 and a molecular weight of 304.39 g/mol. Its IUPAC name is (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide.

Molecular Properties

Compound Name(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide
PubChem CID97311059
Molecular FormulaC17H24N2O3
Molecular Weight304.39 g/mol
Exact Mass304.18
IUPAC Name(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide
SMILESCC[C@H](NC(=O)[C@H]1CCN(C)C(=O)C1)c1ccc(OC)cc1
InChIInChI=1S/C17H24N2O3/c1-4-15(12-5-7-14(22-3)8-6-12)18-17(21)13-9-10-19(2)16(20)11-13/h5-8,13,15H,4,9-11H2,1-3H3,(H,18,21)/t13-,15-/m0/s1
InChIKeyYCKGBRUXIFPMKV-ZFWWWQNUSA-N
XLogP2.13
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide 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-[1-(4-methoxyphenyl)propyl]-1-methylpiperidine-4-carboxamide
CID 132649950
(4S)-N-[(1R)-1-(2-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide
CID 94169792
N-[1-(4-methoxyphenyl)propyl]-1-sulfamoylpiperidine-4-carboxamide
CID 43072801
N-[1-(4-methoxyphenyl)propyl]cyclohexanecarboxamide
CID 18115473
(3R)-3-(4-tert-butylphenyl)-3-[[(4S)-1-methyl-2-oxopiperidine-4-carbonyl]amino]propanoic acid
CID 99645041
1-[(4-fluorophenyl)methyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide
CID 46776533
4-[(1-methyl-2-oxopiperidine-4-carbonyl)amino]-4-phenylbutanoic acid
CID 119201075
1-[(2-chloro-3-pyridinyl)sulfonyl]-N-[1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide
CID 55512060
(4R)-1-methyl-N-[(1R)-1-[4-(3-methylbutoxy)phenyl]ethyl]-2-oxopiperidine-4-carboxamide
CID 95337098
(2S,4S)-N-[1-(4-methoxyphenyl)propyl]-2-methylpiperidine-4-carboxamide
CID 120618239
N-[1-(4-methoxyphenyl)propyl]piperidine-3-carboxamide
CID 43708609
1-[(2,4-dichlorophenyl)methyl]-N-[(1S)-1-(4-methoxyphenyl)propyl]piperidine-4-carboxamide
CID 94024957

Frequently Asked Questions

What is the IUPAC name of (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide?
The IUPAC name of (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide (CID 97311059) is (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide.
What is the SMILES notation for (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide?
The canonical SMILES for (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide is CC[C@H](NC(=O)[C@H]1CCN(C)C(=O)C1)c1ccc(OC)cc1.
What is the InChIKey of (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide?
The InChIKey is YCKGBRUXIFPMKV-ZFWWWQNUSA-N. The full InChI is InChI=1S/C17H24N2O3/c1-4-15(12-5-7-14(22-3)8-6-12)18-17(21)13-9-10-19(2)16(20)11-13/h5-8,13,15H,4,9-11H2,1-3H3,(H,18,21)/t13-,15-/m0/s1.
What are the key properties of (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide?
(4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide has a molecular weight of 304.39 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-N-[(1S)-1-(4-methoxyphenyl)propyl]-1-methyl-2-oxopiperidine-4-carboxamide is sourced from PubChem (CID 97311059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).