1-(2-ethylphenyl)cyclohexane-1-carboxamide

C15H21NO — CID 70002174

IUPAC1-(2-ethylphenyl)cyclohexane-1-carboxamide
SMILESCCc1ccccc1C1(C(N)=O)CCCCC1
InChIInChI=1S/C15H21NO/c1-2-12-8-4-5-9-13(12)15(14(16)17)10-6-3-7-11-15/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H2,16,17)
InChIKeyXFMMMCTXIKGILT-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.94
Rot. Bonds3

About 1-(2-ethylphenyl)cyclohexane-1-carboxamide

1-(2-ethylphenyl)cyclohexane-1-carboxamide (PubChem CID 70002174) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is 1-(2-ethylphenyl)cyclohexane-1-carboxamide.

Molecular Properties

Compound Name1-(2-ethylphenyl)cyclohexane-1-carboxamide
PubChem CID70002174
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC Name1-(2-ethylphenyl)cyclohexane-1-carboxamide
SMILESCCc1ccccc1C1(C(N)=O)CCCCC1
InChIInChI=1S/C15H21NO/c1-2-12-8-4-5-9-13(12)15(14(16)17)10-6-3-7-11-15/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H2,16,17)
InChIKeyXFMMMCTXIKGILT-UHFFFAOYSA-N
XLogP2.94
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-2-(1-methylcyclohexyl)benzene
CID 71388043
1-ethyl-2-(1-phenylcyclohexyl)benzene
CID 173103892
1-phenylcyclopentane-1-carboxamide;dihydrochloride
CID 142770378
[2-(1-carbamoylcyclopropyl)phenyl]-ethylphosphinic acid
CID 67450447
1-ethyl-2-(1-methylcyclopropyl)benzene
CID 159457971
1-[2-(2,2-difluoropropyl)phenyl]cyclohexane-1-carboxylic acid
CID 117453717
1-[2-(2-hydroxy-2-methylpropyl)phenyl]cyclopentane-1-carboxylic acid
CID 117114104
1-(5-bromo-2-ethylphenyl)cyclohexane-1-carboxylic acid
CID 117496068
1-(3,4-diethylphenyl)cyclohexane-1-carboxylic acid
CID 117405456
1-ethyl-2-[1-(isothiocyanatomethyl)cyclohexyl]benzene
CID 23348524
[2-(2,6-diethylanilino)-2-oxoethyl] 1-phenylcyclopentane-1-carboxylate
CID 8611306
2-[1-(aminomethyl)cyclopentyl]-6-ethylphenol
CID 117313437

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)cyclohexane-1-carboxamide?
The IUPAC name of 1-(2-ethylphenyl)cyclohexane-1-carboxamide (CID 70002174) is 1-(2-ethylphenyl)cyclohexane-1-carboxamide.
What is the SMILES notation for 1-(2-ethylphenyl)cyclohexane-1-carboxamide?
The canonical SMILES for 1-(2-ethylphenyl)cyclohexane-1-carboxamide is CCc1ccccc1C1(C(N)=O)CCCCC1.
What is the InChIKey of 1-(2-ethylphenyl)cyclohexane-1-carboxamide?
The InChIKey is XFMMMCTXIKGILT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-12-8-4-5-9-13(12)15(14(16)17)10-6-3-7-11-15/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H2,16,17).
What are the key properties of 1-(2-ethylphenyl)cyclohexane-1-carboxamide?
1-(2-ethylphenyl)cyclohexane-1-carboxamide has a molecular weight of 231.34 g/mol, XLogP of 2.94, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)cyclohexane-1-carboxamide is sourced from PubChem (CID 70002174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).