N-(1-phenylcyclohexyl)butanamide

C16H23NO — CID 110478581

IUPACN-(1-phenylcyclohexyl)butanamide
SMILESCCCC(=O)NC1(c2ccccc2)CCCCC1
InChIInChI=1S/C16H23NO/c1-2-9-15(18)17-16(12-7-4-8-13-16)14-10-5-3-6-11-14/h3,5-6,10-11H,2,4,7-9,12-13H2,1H3,(H,17,18)
InChIKeyJGPFLONVXULIRV-UHFFFAOYSA-N
MW245.37 g/mol
LogP3.76
Rot. Bonds4

About N-(1-phenylcyclohexyl)butanamide

N-(1-phenylcyclohexyl)butanamide (PubChem CID 110478581) has the molecular formula C16H23NO and a molecular weight of 245.37 g/mol. Its IUPAC name is N-(1-phenylcyclohexyl)butanamide.

Molecular Properties

Compound NameN-(1-phenylcyclohexyl)butanamide
PubChem CID110478581
Molecular FormulaC16H23NO
Molecular Weight245.37 g/mol
Exact Mass245.18
IUPAC NameN-(1-phenylcyclohexyl)butanamide
SMILESCCCC(=O)NC1(c2ccccc2)CCCCC1
InChIInChI=1S/C16H23NO/c1-2-9-15(18)17-16(12-7-4-8-13-16)14-10-5-3-6-11-14/h3,5-6,10-11H,2,4,7-9,12-13H2,1H3,(H,17,18)
InChIKeyJGPFLONVXULIRV-UHFFFAOYSA-N
XLogP3.76
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.37
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-oxo-4-[(1-phenylcyclohexyl)amino]butanoic acid
CID 110465792
4-oxo-4-[(1-phenylcyclopentyl)amino]butanoic acid
CID 110442749
N-(1-phenylcyclopropyl)propanamide
CID 110441332
acetic acid;azane;N-ethyl-1-phenylcyclohexan-1-amine
CID 19095095
N-[1-(4-chlorophenyl)cyclopropyl]butanamide
CID 113091058
N,N'-bis(1-phenylcyclopropyl)propanediamide
CID 166301287
2-ethoxy-N-(1-phenylcyclobutyl)acetamide
CID 52571502
ethyl N-(1-phenylcyclopentyl)carbamate
CID 110445044
ethyl 2-oxo-2-[(1-phenylcyclohexyl)amino]acetate
CID 110481846
2-cyclohexyl-N-(1-phenylcyclobutyl)acetamide
CID 55461959
3-amino-N-[1-(4-methoxyphenyl)cyclohexyl]propanamide
CID 110478988
N-[3-oxo-3-[(1-phenylcyclopentyl)amino]propyl]pyridine-4-carboxamide
CID 75371465

Frequently Asked Questions

What is the IUPAC name of N-(1-phenylcyclohexyl)butanamide?
The IUPAC name of N-(1-phenylcyclohexyl)butanamide (CID 110478581) is N-(1-phenylcyclohexyl)butanamide.
What is the SMILES notation for N-(1-phenylcyclohexyl)butanamide?
The canonical SMILES for N-(1-phenylcyclohexyl)butanamide is CCCC(=O)NC1(c2ccccc2)CCCCC1.
What is the InChIKey of N-(1-phenylcyclohexyl)butanamide?
The InChIKey is JGPFLONVXULIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO/c1-2-9-15(18)17-16(12-7-4-8-13-16)14-10-5-3-6-11-14/h3,5-6,10-11H,2,4,7-9,12-13H2,1H3,(H,17,18).
What are the key properties of N-(1-phenylcyclohexyl)butanamide?
N-(1-phenylcyclohexyl)butanamide has a molecular weight of 245.37 g/mol, XLogP of 3.76, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-phenylcyclohexyl)butanamide is sourced from PubChem (CID 110478581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).