4-butyl-N-cyclopentylbenzamide

C16H23NO — CID 60674795

IUPAC4-butyl-N-cyclopentylbenzamide
SMILESCCCCc1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H23NO/c1-2-3-6-13-9-11-14(12-10-13)16(18)17-15-7-4-5-8-15/h9-12,15H,2-8H2,1H3,(H,17,18)
InChIKeyKRXSWVYDVXLRQD-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.70
Rot. Bonds5

About 4-butyl-N-cyclopentylbenzamide

4-butyl-N-cyclopentylbenzamide (PubChem CID 60674795) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is 4-butyl-N-cyclopentylbenzamide.

Molecular Properties

Compound Name4-butyl-N-cyclopentylbenzamide
PubChem CID60674795
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC Name4-butyl-N-cyclopentylbenzamide
SMILESCCCCc1ccc(C(=O)NC2CCCC2)cc1
InChIInChI=1S/C16H23NO/c1-2-3-6-13-9-11-14(12-10-13)16(18)17-15-7-4-5-8-15/h9-12,15H,2-8H2,1H3,(H,17,18)
InChIKeyKRXSWVYDVXLRQD-UHFFFAOYSA-N
XLogP3.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 3315464
4-butyl-N-[2-(hydroxymethyl)cyclohexyl]benzamide
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4-N-cyclopentyl-1-N-propylbenzene-1,4-dicarboxamide
CID 109042876
4-butyl-N-[2-(hydroxymethyl)cyclopentyl]benzamide
CID 103774443
N-cyclopentyl-4-(hydroxymethyl)benzamide
CID 60636896
4-butoxy-N-cyclobutylbenzamide
CID 71449411
N-cyclohexyl-4-(2-pyridin-4-ylethyl)benzamide
CID 67802758
N'-(4-butylphenyl)-N-cycloheptyloxamide
CID 108502498
4-decyl-N-[(3S)-pyrrolidin-3-yl]benzamide;hydrochloride
CID 162755757
4-butyl-N-[(3R)-2-oxopiperidin-3-yl]benzamide
CID 54765874
N-cyclooctyl-4-(propylamino)benzamide
CID 62172072
1-N-[2-(4-chlorophenyl)ethyl]-4-N-cyclopentylbenzene-1,4-dicarboxamide
CID 109044439

Frequently Asked Questions

What is the IUPAC name of 4-butyl-N-cyclopentylbenzamide?
The IUPAC name of 4-butyl-N-cyclopentylbenzamide (CID 60674795) is 4-butyl-N-cyclopentylbenzamide.
What is the SMILES notation for 4-butyl-N-cyclopentylbenzamide?
The canonical SMILES for 4-butyl-N-cyclopentylbenzamide is CCCCc1ccc(C(=O)NC2CCCC2)cc1.
What is the InChIKey of 4-butyl-N-cyclopentylbenzamide?
The InChIKey is KRXSWVYDVXLRQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-2-3-6-13-9-11-14(12-10-13)16(18)17-15-7-4-5-8-15/h9-12,15H,2-8H2,1H3,(H,17,18).
What are the key properties of 4-butyl-N-cyclopentylbenzamide?
4-butyl-N-cyclopentylbenzamide has a molecular weight of 245.37 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-N-cyclopentylbenzamide is sourced from PubChem (CID 60674795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).