1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide

C18H27N3O2 — CID 42914018

IUPAC1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)CN1CCCCC1C(N)=O
InChIInChI=1S/C18H27N3O2/c1-14(10-11-15-7-3-2-4-8-15)20-17(22)13-21-12-6-5-9-16(21)18(19)23/h2-4,7-8,14,16H,5-6,9-13H2,1H3,(H2,19,23)(H,20,22)
InChIKeyGOKKUESWFFFTKA-UHFFFAOYSA-N
MW317.43 g/mol
LogP1.46
Rot. Bonds7

About 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide

1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide (PubChem CID 42914018) has the molecular formula C18H27N3O2 and a molecular weight of 317.43 g/mol. Its IUPAC name is 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide.

Molecular Properties

Compound Name1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide
PubChem CID42914018
Molecular FormulaC18H27N3O2
Molecular Weight317.43 g/mol
Exact Mass317.21
IUPAC Name1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide
SMILESCC(CCc1ccccc1)NC(=O)CN1CCCCC1C(N)=O
InChIInChI=1S/C18H27N3O2/c1-14(10-11-15-7-3-2-4-8-15)20-17(22)13-21-12-6-5-9-16(21)18(19)23/h2-4,7-8,14,16H,5-6,9-13H2,1H3,(H2,19,23)(H,20,22)
InChIKeyGOKKUESWFFFTKA-UHFFFAOYSA-N
XLogP1.46
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.43
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-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

(2R)-1-[2-oxo-2-[[(1R)-1-phenylethyl]amino]ethyl]piperidine-2-carboxamide
CID 41075375
methyl 1-[2-oxo-2-[[(2S)-4-phenylbutan-2-yl]amino]ethyl]piperidine-4-carboxylate
CID 8742230
1-N-(4-phenylbutan-2-yl)piperidine-1,4-dicarboxamide
CID 51074335
(2S)-1-[2-[(2-methylphenyl)methylamino]-2-oxoethyl]piperidine-2-carboxamide
CID 40987983
1-phenacylpiperidine-2-carboxamide
CID 60681003
1-[2-oxo-2-(pentan-2-ylamino)ethyl]azepane-2-carboxylic acid
CID 64564717
2-(2-oxopyrrolidin-1-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 47111292
(2R)-1-[2-(3-methylanilino)-2-oxoethyl]piperidine-2-carboxamide
CID 40987938
1-[2-[(2-fluorophenyl)methylamino]-2-oxoethyl]piperidine-2-carboxamide
CID 17428154
1-[2-oxo-2-(2-phenylsulfanylanilino)ethyl]piperidine-2-carboxamide
CID 17417342
N-[(2S)-4-phenylbutan-2-yl]cyclopropanecarboxamide
CID 844321
1-[2-(4-phenylbutan-2-ylamino)propanoyl]piperidine-2-carboxylic acid
CID 58641902

Frequently Asked Questions

What is the IUPAC name of 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide?
The IUPAC name of 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide (CID 42914018) is 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide.
What is the SMILES notation for 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide?
The canonical SMILES for 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide is CC(CCc1ccccc1)NC(=O)CN1CCCCC1C(N)=O.
What is the InChIKey of 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide?
The InChIKey is GOKKUESWFFFTKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N3O2/c1-14(10-11-15-7-3-2-4-8-15)20-17(22)13-21-12-6-5-9-16(21)18(19)23/h2-4,7-8,14,16H,5-6,9-13H2,1H3,(H2,19,23)(H,20,22).
What are the key properties of 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide?
1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide has a molecular weight of 317.43 g/mol, XLogP of 1.46, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-(4-phenylbutan-2-ylamino)ethyl]piperidine-2-carboxamide is sourced from PubChem (CID 42914018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).