3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide

C17H24N2O2 — CID 113116330

IUPAC3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide
SMILESCC(=O)N(CCC(=O)NCc1ccccc1)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-14(20)19(16-9-5-6-10-16)12-11-17(21)18-13-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-13H2,1H3,(H,18,21)
InChIKeyPVYPLNRSWUTATF-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.48
Rot. Bonds6

About 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide

3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide (PubChem CID 113116330) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide.

Molecular Properties

Compound Name3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide
PubChem CID113116330
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide
SMILESCC(=O)N(CCC(=O)NCc1ccccc1)C1CCCC1
InChIInChI=1S/C17H24N2O2/c1-14(20)19(16-9-5-6-10-16)12-11-17(21)18-13-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-13H2,1H3,(H,18,21)
InChIKeyPVYPLNRSWUTATF-UHFFFAOYSA-N
XLogP2.48
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[acetyl(cycloheptyl)amino]-N-[(3-methylphenyl)methyl]propanamide
CID 113122642
3-[acetyl(cyclopentyl)amino]-N-[(2-chlorophenyl)methyl]propanamide
CID 113116338
3-[acetyl(cyclopentyl)amino]-N-[(2-methoxyphenyl)methyl]propanamide
CID 113116340
ethyl 4-[acetyl-[3-[(4-methylphenyl)methylamino]-3-oxopropyl]amino]piperidine-1-carboxylate
CID 113122143
3-[acetyl-(1,1-dioxothiolan-3-yl)amino]-N-[(3-methylphenyl)methyl]propanamide
CID 113121597
3-(N-acetyl-4-piperidin-1-ylanilino)-N-benzylpropanamide
CID 113132055
3-[acetyl(3-phenylpropyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 113122219
N-benzyl-N'-cyclohexylpropanediamide
CID 108942512
3-(N-acetyl-2-fluoroanilino)-N-benzylpropanamide
CID 113126653
3-[acetyl(benzyl)amino]-N-[(4-methylphenyl)methyl]propanamide
CID 113118207
3-(N-acetyl-2,3-dichloroanilino)-N-benzylpropanamide
CID 113134286
N-benzyl-2-[methyl-(4-oxocyclohexyl)amino]acetamide
CID 79119765

Frequently Asked Questions

What is the IUPAC name of 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide?
The IUPAC name of 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide (CID 113116330) is 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide.
What is the SMILES notation for 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide?
The canonical SMILES for 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide is CC(=O)N(CCC(=O)NCc1ccccc1)C1CCCC1.
What is the InChIKey of 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide?
The InChIKey is PVYPLNRSWUTATF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-14(20)19(16-9-5-6-10-16)12-11-17(21)18-13-15-7-3-2-4-8-15/h2-4,7-8,16H,5-6,9-13H2,1H3,(H,18,21).
What are the key properties of 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide?
3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide has a molecular weight of 288.39 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[acetyl(cyclopentyl)amino]-N-benzylpropanamide is sourced from PubChem (CID 113116330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).