2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide

C14H18ClNO2 — CID 142798968

IUPAC2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide
SMILESNC(=O)C(c1ccc(Cl)cc1)C1CCC(O)CC1
InChIInChI=1S/C14H18ClNO2/c15-11-5-1-9(2-6-11)13(14(16)18)10-3-7-12(17)8-4-10/h1-2,5-6,10,12-13,17H,3-4,7-8H2,(H2,16,18)
InChIKeyXXFYTEUPAUPGTQ-UHFFFAOYSA-N
MW267.76 g/mol
LogP2.46
Rot. Bonds3

About 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide

2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide (PubChem CID 142798968) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide
PubChem CID142798968
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Name2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide
SMILESNC(=O)C(c1ccc(Cl)cc1)C1CCC(O)CC1
InChIInChI=1S/C14H18ClNO2/c15-11-5-1-9(2-6-11)13(14(16)18)10-3-7-12(17)8-4-10/h1-2,5-6,10,12-13,17H,3-4,7-8H2,(H2,16,18)
InChIKeyXXFYTEUPAUPGTQ-UHFFFAOYSA-N
XLogP2.46
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-3-(4-chlorophenyl)-N,5-dihydroxypentanamide
CID 45105064
(3S)-3-(4-chlorophenyl)-N,5-dihydroxypentanamide
CID 45105066
1-(4-Chloro-3-fluorophenyl)-2-(hydroxymethyl)cyclohexane-1-carboxamide
CID 91103310
(6R)-6-[4-(4-chlorophenyl)phenyl]-N,6-dihydroxyhexanamide
CID 9797738
6-[4-(4-chlorophenyl)phenyl]-N,6-dihydroxyhexanamide
CID 9819038
(6S)-6-[4-(4-chlorophenyl)phenyl]-N,6-dihydroxyhexanamide
CID 9927632
6-[4-(4-chlorophenyl)phenyl]-N,6-dihydroxy-2-methylhexanamide
CID 9946257
6-[3-(4-chlorophenyl)phenyl]-N,6-dihydroxyhexanamide
CID 9949529
8-[4-(4-chlorophenyl)phenyl]-N,8-dihydroxyoctanamide
CID 10109248
7-[4-(4-chlorophenyl)phenyl]-N,7-dihydroxyheptanamide
CID 10269202
2-(4-chlorophenyl)-N-[[(1S,2R)-2-hydroxycyclohexyl]methyl]-2-methylpropanamide
CID 11594741
(2R,4S)-N-carbamoyl-6-(4-chlorophenyl)-2-(cyclohexylmethyl)-4-hydroxyhexanamide
CID 21345528

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide?
The IUPAC name of 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide (CID 142798968) is 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide is NC(=O)C(c1ccc(Cl)cc1)C1CCC(O)CC1.
What is the InChIKey of 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide?
The InChIKey is XXFYTEUPAUPGTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c15-11-5-1-9(2-6-11)13(14(16)18)10-3-7-12(17)8-4-10/h1-2,5-6,10,12-13,17H,3-4,7-8H2,(H2,16,18).
What are the key properties of 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide?
2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide has a molecular weight of 267.76 g/mol, XLogP of 2.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-(4-hydroxycyclohexyl)acetamide is sourced from PubChem (CID 142798968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).