N-(3-chlorophenyl)-2-cyclohexylacetamide

C14H18ClNO — CID 11379743

IUPACN-(3-chlorophenyl)-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C14H18ClNO/c15-12-7-4-8-13(10-12)16-14(17)9-11-5-2-1-3-6-11/h4,7-8,10-11H,1-3,5-6,9H2,(H,16,17)
InChIKeyPOFHQQJQPBOESX-UHFFFAOYSA-N
MW251.76 g/mol
LogP4.25
Rot. Bonds3

About N-(3-chlorophenyl)-2-cyclohexylacetamide

N-(3-chlorophenyl)-2-cyclohexylacetamide (PubChem CID 11379743) has the molecular formula C14H18ClNO and a molecular weight of 251.76 g/mol. Its IUPAC name is N-(3-chlorophenyl)-2-cyclohexylacetamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-2-cyclohexylacetamide
PubChem CID11379743
Molecular FormulaC14H18ClNO
Molecular Weight251.76 g/mol
Exact Mass251.11
IUPAC NameN-(3-chlorophenyl)-2-cyclohexylacetamide
SMILESO=C(CC1CCCCC1)Nc1cccc(Cl)c1
InChIInChI=1S/C14H18ClNO/c15-12-7-4-8-13(10-12)16-14(17)9-11-5-2-1-3-6-11/h4,7-8,10-11H,1-3,5-6,9H2,(H,16,17)
InChIKeyPOFHQQJQPBOESX-UHFFFAOYSA-N
XLogP4.25
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.76
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-2-cyclohexylacetamide?
The IUPAC name of N-(3-chlorophenyl)-2-cyclohexylacetamide (CID 11379743) is N-(3-chlorophenyl)-2-cyclohexylacetamide.
What is the SMILES notation for N-(3-chlorophenyl)-2-cyclohexylacetamide?
The canonical SMILES for N-(3-chlorophenyl)-2-cyclohexylacetamide is O=C(CC1CCCCC1)Nc1cccc(Cl)c1.
What is the InChIKey of N-(3-chlorophenyl)-2-cyclohexylacetamide?
The InChIKey is POFHQQJQPBOESX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO/c15-12-7-4-8-13(10-12)16-14(17)9-11-5-2-1-3-6-11/h4,7-8,10-11H,1-3,5-6,9H2,(H,16,17).
What are the key properties of N-(3-chlorophenyl)-2-cyclohexylacetamide?
N-(3-chlorophenyl)-2-cyclohexylacetamide has a molecular weight of 251.76 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-2-cyclohexylacetamide is sourced from PubChem (CID 11379743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).