(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide

C23H34N2O3 — CID 69321917

IUPAC(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide
SMILESCCC(=O)CCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)NC1CCCC1
InChIInChI=1S/C23H34N2O3/c1-2-20(26)15-7-4-8-16-21(23(28)24-19-13-9-10-14-19)25-22(27)17-18-11-5-3-6-12-18/h3,5-6,11-12,19,21H,2,4,7-10,13-17H2,1H3,(H,24,28)(H,25,27)/t21-/m0/s1
InChIKeyONZJYUXKRGPBTI-NRFANRHFSA-N
MW386.54 g/mol
LogP3.70
Rot. Bonds12

About (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide

(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide (PubChem CID 69321917) has the molecular formula C23H34N2O3 and a molecular weight of 386.54 g/mol. Its IUPAC name is (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide.

Molecular Properties

Compound Name(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide
PubChem CID69321917
Molecular FormulaC23H34N2O3
Molecular Weight386.54 g/mol
Exact Mass386.26
IUPAC Name(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide
SMILESCCC(=O)CCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)NC1CCCC1
InChIInChI=1S/C23H34N2O3/c1-2-20(26)15-7-4-8-16-21(23(28)24-19-13-9-10-14-19)25-22(27)17-18-11-5-3-6-12-18/h3,5-6,11-12,19,21H,2,4,7-10,13-17H2,1H3,(H,24,28)(H,25,27)/t21-/m0/s1
InChIKeyONZJYUXKRGPBTI-NRFANRHFSA-N
XLogP3.70
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.54
LogP ≤ 53.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[(2S)-1-[(1-benzylpiperidin-4-yl)amino]-1,8-dioxodecan-2-yl]-1-methylpiperidine-4-carboxamide
CID 69319489
2-[(2-phenylacetyl)amino]-N-(thian-4-yl)pentanamide
CID 56788135
N-cyclopentyl-3-methyl-2-[(2-phenylacetyl)amino]butanamide
CID 42909311
benzyl N-[(2S)-6-amino-1-(cyclopentylamino)-1-oxohexan-2-yl]carbamate
CID 140895488
N-cyclopentyl-2-phenylacetamide;hydrochloride
CID 69292876
4-methylsulfanyl-2-[(2-phenylacetyl)amino]-N-piperidin-3-ylbutanamide
CID 119427928
[(2S)-1-[2-(naphthalene-2-carbonyl)hydrazinyl]-1,8-dioxodecan-2-yl]carbamic acid
CID 67268811
S-[(6S)-6-benzamido-7-(cyclopentylamino)-7-oxoheptyl] 2-methylpropanethioate
CID 23636245
(2S)-2-(4-methylpentanoylamino)-N-naphthalen-2-yl-8-oxodecanamide
CID 69322278
N-cyclopentyl-3-hydroxy-2-[(2-naphthalen-2-ylacetyl)amino]propanamide
CID 3602543
N-[2-(cyclohexylamino)-2-oxoethyl]-2-phenylacetamide
CID 51160966
4-benzyl-N-cyclohexylnonanamide
CID 176730329

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide?
The IUPAC name of (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide (CID 69321917) is (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide.
What is the SMILES notation for (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide?
The canonical SMILES for (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide is CCC(=O)CCCCC[C@H](NC(=O)Cc1ccccc1)C(=O)NC1CCCC1.
What is the InChIKey of (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide?
The InChIKey is ONZJYUXKRGPBTI-NRFANRHFSA-N. The full InChI is InChI=1S/C23H34N2O3/c1-2-20(26)15-7-4-8-16-21(23(28)24-19-13-9-10-14-19)25-22(27)17-18-11-5-3-6-12-18/h3,5-6,11-12,19,21H,2,4,7-10,13-17H2,1H3,(H,24,28)(H,25,27)/t21-/m0/s1.
What are the key properties of (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide?
(2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide has a molecular weight of 386.54 g/mol, XLogP of 3.70, 12 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopentyl-8-oxo-2-[(2-phenylacetyl)amino]decanamide is sourced from PubChem (CID 69321917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).