(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide

C20H30N2O2 — CID 97347649

IUPAC(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide
SMILESCC(C)C[C@H]1C[C@H](C(=O)NCC(C)(C)c2ccccc2)CC(=O)N1
InChIInChI=1S/C20H30N2O2/c1-14(2)10-17-11-15(12-18(23)22-17)19(24)21-13-20(3,4)16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3,(H,21,24)(H,22,23)/t15-,17-/m0/s1
InChIKeyRGSOJCDUMBZQLF-RDJZCZTQSA-N
MW330.47 g/mol
LogP3.02
Rot. Bonds6

About (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide

(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide (PubChem CID 97347649) has the molecular formula C20H30N2O2 and a molecular weight of 330.47 g/mol. Its IUPAC name is (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide.

Molecular Properties

Compound Name(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide
PubChem CID97347649
Molecular FormulaC20H30N2O2
Molecular Weight330.47 g/mol
Exact Mass330.23
IUPAC Name(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide
SMILESCC(C)C[C@H]1C[C@H](C(=O)NCC(C)(C)c2ccccc2)CC(=O)N1
InChIInChI=1S/C20H30N2O2/c1-14(2)10-17-11-15(12-18(23)22-17)19(24)21-13-20(3,4)16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3,(H,21,24)(H,22,23)/t15-,17-/m0/s1
InChIKeyRGSOJCDUMBZQLF-RDJZCZTQSA-N
XLogP3.02
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.47
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-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

CID 65833
CID 65833
CID 6917779
CID 6917779
CID 163701
CID 163701
CID 102669
CID 102669
CID 11622909
CID 11622909
CID 65996
CID 65996
CID 9908389
CID 9908389
CID 6917778
CID 6917778
CID 7076347
CID 7076347
CID 38310
CID 38310
CID 7076549
CID 7076549
CID 3082491
CID 3082491

Frequently Asked Questions

What is the IUPAC name of (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide?
The IUPAC name of (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide (CID 97347649) is (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide.
What is the SMILES notation for (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide?
The canonical SMILES for (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide is CC(C)C[C@H]1C[C@H](C(=O)NCC(C)(C)c2ccccc2)CC(=O)N1.
What is the InChIKey of (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide?
The InChIKey is RGSOJCDUMBZQLF-RDJZCZTQSA-N. The full InChI is InChI=1S/C20H30N2O2/c1-14(2)10-17-11-15(12-18(23)22-17)19(24)21-13-20(3,4)16-8-6-5-7-9-16/h5-9,14-15,17H,10-13H2,1-4H3,(H,21,24)(H,22,23)/t15-,17-/m0/s1.
What are the key properties of (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide?
(2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide has a molecular weight of 330.47 g/mol, XLogP of 3.02, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,4S)-N-(2-methyl-2-phenylpropyl)-2-(2-methylpropyl)-6-oxopiperidine-4-carboxamide is sourced from PubChem (CID 97347649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).