N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide

C14H16ClF2NO — CID 121319752

IUPACN-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide
SMILESO=C(CC1CCC(F)(F)CC1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H16ClF2NO/c15-11-1-3-12(4-2-11)18-13(19)9-10-5-7-14(16,17)8-6-10/h1-4,10H,5-9H2,(H,18,19)
InChIKeyFMMNAHMRUZGRKG-UHFFFAOYSA-N
MW287.74 g/mol
LogP4.49
Rot. Bonds3

About N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide

N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide (PubChem CID 121319752) has the molecular formula C14H16ClF2NO and a molecular weight of 287.74 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide
PubChem CID121319752
Molecular FormulaC14H16ClF2NO
Molecular Weight287.74 g/mol
Exact Mass287.09
IUPAC NameN-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide
SMILESO=C(CC1CCC(F)(F)CC1)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H16ClF2NO/c15-11-1-3-12(4-2-11)18-13(19)9-10-5-7-14(16,17)8-6-10/h1-4,10H,5-9H2,(H,18,19)
InChIKeyFMMNAHMRUZGRKG-UHFFFAOYSA-N
XLogP4.49
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.74
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-chlorophenyl)-2-(1,1-dioxothian-4-yl)acetamide
CID 110858953
2-(4-acetylcyclohexyl)-N-(4-chlorophenyl)acetamide
CID 121319520
bis(2-[4-(4-chloro-2-fluorophenyl)cyclohexyl]-N-(4-chlorophenyl)acetamide);methane
CID 167552414
N-(4-chlorophenyl)-2-[4-(2,3-difluorophenyl)cyclohexyl]acetamide
CID 174865886
N-(4-chlorophenyl)-2-[4-(6-fluoroquinolin-4-yl)-4-hydroxycyclohexyl]acetamide
CID 145078404
2-cyclopentyl-N-(4-propan-2-ylphenyl)acetamide
CID 11839703
N-(4-chlorophenyl)-2-(4-phenylmethoxycyclohexyl)acetamide
CID 138554091
2-cyclopropyl-N-(4-sulfanylphenyl)acetamide
CID 68600520
2-cyclopropyl-N-phenylacetamide
CID 60753326
N-(4-chlorophenyl)-2-[4-(3-methylphenyl)cyclohexyl]acetamide
CID 161440636
N-[4-[(4-chlorophenyl)carbamoylamino]phenyl]-2-(cyclopropylmethylamino)acetamide
CID 119752578
3-[4-[2-(4-chloroanilino)-2-oxoethyl]cyclohexyl]benzoic acid
CID 121319777

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide?
The IUPAC name of N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide (CID 121319752) is N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide is O=C(CC1CCC(F)(F)CC1)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide?
The InChIKey is FMMNAHMRUZGRKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClF2NO/c15-11-1-3-12(4-2-11)18-13(19)9-10-5-7-14(16,17)8-6-10/h1-4,10H,5-9H2,(H,18,19).
What are the key properties of N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide?
N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide has a molecular weight of 287.74 g/mol, XLogP of 4.49, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(4,4-difluorocyclohexyl)acetamide is sourced from PubChem (CID 121319752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).