N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide

C15H20ClNO — CID 145182174

IUPACN-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide
SMILESCCN(C(=O)C1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C15H20ClNO/c1-2-17(14-11-7-6-10-13(14)16)15(18)12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3
InChIKeyQTRMISFCGITQRC-UHFFFAOYSA-N
MW265.78 g/mol
LogP4.27
Rot. Bonds3

About N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide

N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide (PubChem CID 145182174) has the molecular formula C15H20ClNO and a molecular weight of 265.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide
PubChem CID145182174
Molecular FormulaC15H20ClNO
Molecular Weight265.78 g/mol
Exact Mass265.12
IUPAC NameN-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide
SMILESCCN(C(=O)C1CCCCC1)c1ccccc1Cl
InChIInChI=1S/C15H20ClNO/c1-2-17(14-11-7-6-10-13(14)16)15(18)12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3
InChIKeyQTRMISFCGITQRC-UHFFFAOYSA-N
XLogP4.27
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.78
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-N-phenylcyclohexanecarboxamide
CID 3884538
N-ethyl-N-phenylcyclobutanecarboxamide
CID 39946342
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
N-[4-(aminomethyl)phenyl]-N-ethylcyclooctanecarboxamide
CID 65019275
S-[2-[cyclohexanecarbonyl(2-ethylbutyl)amino]phenyl] ethanethioate
CID 87120978
1-(2-chlorophenyl)-1-ethyl-3-(oxomethylidene)urea
CID 134892075
N-(3-aminopropyl)-N-(2-methylphenyl)cycloheptanecarboxamide
CID 62586297
2-[2-amino-N-(cycloheptanecarbonyl)anilino]acetic acid
CID 63118253
4-[ethyl(phenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784653
N-[2,3-dimethyl-5-(4-phenoxyphenyl)phenyl]-N-ethylcyclopentanecarboxamide
CID 170243588
N-(2,3-dimethylphenyl)-N-ethylthiane-4-carboxamide
CID 146419249
3-[ethyl-(2-fluorophenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 103550638

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide?
The IUPAC name of N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide (CID 145182174) is N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide.
What is the SMILES notation for N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide?
The canonical SMILES for N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide is CCN(C(=O)C1CCCCC1)c1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide?
The InChIKey is QTRMISFCGITQRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20ClNO/c1-2-17(14-11-7-6-10-13(14)16)15(18)12-8-4-3-5-9-12/h6-7,10-12H,2-5,8-9H2,1H3.
What are the key properties of N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide?
N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide has a molecular weight of 265.78 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-N-ethylcyclohexanecarboxamide is sourced from PubChem (CID 145182174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).