N-[1-(3-phenylpropyl)cyclohexyl]acetamide

C17H25NO — CID 143104770

IUPACN-[1-(3-phenylpropyl)cyclohexyl]acetamide
SMILESCC(=O)NC1(CCCc2ccccc2)CCCCC1
InChIInChI=1S/C17H25NO/c1-15(19)18-17(12-6-3-7-13-17)14-8-11-16-9-4-2-5-10-16/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,18,19)
InChIKeyAGDXQPQYVZVIKN-UHFFFAOYSA-N
MW259.39 g/mol
LogP3.85
Rot. Bonds5

About N-[1-(3-phenylpropyl)cyclohexyl]acetamide

N-[1-(3-phenylpropyl)cyclohexyl]acetamide (PubChem CID 143104770) has the molecular formula C17H25NO and a molecular weight of 259.39 g/mol. Its IUPAC name is N-[1-(3-phenylpropyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-[1-(3-phenylpropyl)cyclohexyl]acetamide
PubChem CID143104770
Molecular FormulaC17H25NO
Molecular Weight259.39 g/mol
Exact Mass259.19
IUPAC NameN-[1-(3-phenylpropyl)cyclohexyl]acetamide
SMILESCC(=O)NC1(CCCc2ccccc2)CCCCC1
InChIInChI=1S/C17H25NO/c1-15(19)18-17(12-6-3-7-13-17)14-8-11-16-9-4-2-5-10-16/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,18,19)
InChIKeyAGDXQPQYVZVIKN-UHFFFAOYSA-N
XLogP3.85
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.39
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[1-[2-(3-methoxyphenyl)ethyl]cyclohexyl]acetamide
CID 70592832
N-[1-(aminomethyl)cyclopentyl]-4-phenylbutanamide
CID 63754522
3-phenylpropyl 2-[1-(methylamino)cyclohexyl]acetate
CID 65240364
N'-[1-(hydroxymethyl)cyclopentyl]-N-(3-phenylpropyl)oxamide
CID 110008529
methyl 1-(3-phenylpropyl)cyclopropane-1-carboxylate
CID 86231403
benzyl N-[1-(3-oxobutyl)cyclopentyl]carbamate
CID 59454089
N-(1-benzylcyclohexyl)-2-phenylacetamide
CID 84509764
N-[1-(hydroxymethyl)cyclohexyl]-2-(2-phenylethylsulfanyl)acetamide
CID 62521811
N-[1-(chloromethyl)cyclopentyl]-3-phenylpropanamide
CID 114300597
2-[1-[(2-methyl-5-phenylpentanoyl)amino]cyclobutyl]acetic acid
CID 120521927
2-[1-[(2-phenylacetyl)amino]cyclohexyl]acetic acid
CID 64671959
(2R)-2-(3-phenylpropyl)pyrrolidine-2-carboxylic acid;hydrochloride
CID 45026916

Frequently Asked Questions

What is the IUPAC name of N-[1-(3-phenylpropyl)cyclohexyl]acetamide?
The IUPAC name of N-[1-(3-phenylpropyl)cyclohexyl]acetamide (CID 143104770) is N-[1-(3-phenylpropyl)cyclohexyl]acetamide.
What is the SMILES notation for N-[1-(3-phenylpropyl)cyclohexyl]acetamide?
The canonical SMILES for N-[1-(3-phenylpropyl)cyclohexyl]acetamide is CC(=O)NC1(CCCc2ccccc2)CCCCC1.
What is the InChIKey of N-[1-(3-phenylpropyl)cyclohexyl]acetamide?
The InChIKey is AGDXQPQYVZVIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25NO/c1-15(19)18-17(12-6-3-7-13-17)14-8-11-16-9-4-2-5-10-16/h2,4-5,9-10H,3,6-8,11-14H2,1H3,(H,18,19).
What are the key properties of N-[1-(3-phenylpropyl)cyclohexyl]acetamide?
N-[1-(3-phenylpropyl)cyclohexyl]acetamide has a molecular weight of 259.39 g/mol, XLogP of 3.85, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(3-phenylpropyl)cyclohexyl]acetamide is sourced from PubChem (CID 143104770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).