4-(4-chlorophenyl)-4-hydroxyhexanamide

C12H16ClNO2 — CID 10083069

IUPAC4-(4-chlorophenyl)-4-hydroxyhexanamide
SMILESCCC(O)(CCC(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C12H16ClNO2/c1-2-12(16,8-7-11(14)15)9-3-5-10(13)6-4-9/h3-6,16H,2,7-8H2,1H3,(H2,14,15)
InChIKeyQGWMYBDOTREUTM-UHFFFAOYSA-N
MW241.72 g/mol
LogP2.20
Rot. Bonds5

About 4-(4-chlorophenyl)-4-hydroxyhexanamide

4-(4-chlorophenyl)-4-hydroxyhexanamide (PubChem CID 10083069) has the molecular formula C12H16ClNO2 and a molecular weight of 241.72 g/mol. Its IUPAC name is 4-(4-chlorophenyl)-4-hydroxyhexanamide.

Molecular Properties

Compound Name4-(4-chlorophenyl)-4-hydroxyhexanamide
PubChem CID10083069
Molecular FormulaC12H16ClNO2
Molecular Weight241.72 g/mol
Exact Mass241.09
IUPAC Name4-(4-chlorophenyl)-4-hydroxyhexanamide
SMILESCCC(O)(CCC(N)=O)c1ccc(Cl)cc1
InChIInChI=1S/C12H16ClNO2/c1-2-12(16,8-7-11(14)15)9-3-5-10(13)6-4-9/h3-6,16H,2,7-8H2,1H3,(H2,14,15)
InChIKeyQGWMYBDOTREUTM-UHFFFAOYSA-N
XLogP2.20
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.72
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

gamma-Hydroxy-gamma-ethyl-gamma-phenylbutyramide
CID 128930
2-(3-Chlorophenyl)-2-hydroxynonanamide
CID 10039502
(2S)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883321
(2R)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883322
Acetamide, 2-(p-chlorophenyl)-2-hydroxy-
CID 29140
3-(4-chlorophenyl)-N,3-dihydroxypropanamide
CID 72707667
Benzenebutanamide, alpha-((bis(2-methylpropyl)amino)methyl)-4-chloro-gamma-hydroxy-, hydrate
CID 3079182
2-(3-Chlorophenyl)-2-hydroxynon-8-enamide
CID 70682599
2-(3-Chlorophenyl)-2-hydroxy-5,9-dimethyldec-8-enamide
CID 70693132
(4E)-2-(3-chlorophenyl)-2-hydroxy-5,9-dimethyldeca-4,8-dienamide
CID 70697237
Propanamide, 3-(4-chlorophenyl)-3-hydroxy-
CID 548076
4-(3,4-Dichlorophenyl)-4-hydroxyhexanamide
CID 10125386

Frequently Asked Questions

What is the IUPAC name of 4-(4-chlorophenyl)-4-hydroxyhexanamide?
The IUPAC name of 4-(4-chlorophenyl)-4-hydroxyhexanamide (CID 10083069) is 4-(4-chlorophenyl)-4-hydroxyhexanamide.
What is the SMILES notation for 4-(4-chlorophenyl)-4-hydroxyhexanamide?
The canonical SMILES for 4-(4-chlorophenyl)-4-hydroxyhexanamide is CCC(O)(CCC(N)=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-(4-chlorophenyl)-4-hydroxyhexanamide?
The InChIKey is QGWMYBDOTREUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16ClNO2/c1-2-12(16,8-7-11(14)15)9-3-5-10(13)6-4-9/h3-6,16H,2,7-8H2,1H3,(H2,14,15).
What are the key properties of 4-(4-chlorophenyl)-4-hydroxyhexanamide?
4-(4-chlorophenyl)-4-hydroxyhexanamide has a molecular weight of 241.72 g/mol, XLogP of 2.20, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chlorophenyl)-4-hydroxyhexanamide is sourced from PubChem (CID 10083069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).