3-(3,4-dichlorophenyl)-3-hydroxypentanamide

C11H13Cl2NO2 — CID 10149274

IUPAC3-(3,4-dichlorophenyl)-3-hydroxypentanamide
SMILESCCC(O)(CC(N)=O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-2-11(16,6-10(14)15)7-3-4-8(12)9(13)5-7/h3-5,16H,2,6H2,1H3,(H2,14,15)
InChIKeyQZTCVTHOJAQQCQ-UHFFFAOYSA-N
MW262.14 g/mol
LogP2.47
Rot. Bonds4

About 3-(3,4-dichlorophenyl)-3-hydroxypentanamide

3-(3,4-dichlorophenyl)-3-hydroxypentanamide (PubChem CID 10149274) has the molecular formula C11H13Cl2NO2 and a molecular weight of 262.14 g/mol. Its IUPAC name is 3-(3,4-dichlorophenyl)-3-hydroxypentanamide.

Molecular Properties

Compound Name3-(3,4-dichlorophenyl)-3-hydroxypentanamide
PubChem CID10149274
Molecular FormulaC11H13Cl2NO2
Molecular Weight262.14 g/mol
Exact Mass261.03
IUPAC Name3-(3,4-dichlorophenyl)-3-hydroxypentanamide
SMILESCCC(O)(CC(N)=O)c1ccc(Cl)c(Cl)c1
InChIInChI=1S/C11H13Cl2NO2/c1-2-11(16,6-10(14)15)7-3-4-8(12)9(13)5-7/h3-5,16H,2,6H2,1H3,(H2,14,15)
InChIKeyQZTCVTHOJAQQCQ-UHFFFAOYSA-N
XLogP2.47
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.14
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-chlorophenyl)-N,3-dihydroxypropanamide
CID 71721721
3-(2,3-dichlorophenyl)-N,3-dihydroxypropanamide
CID 72707671
3-(3,4-dichlorophenyl)-N,3-dihydroxypropanamide
CID 72707672
2-(3-Chlorophenyl)-2-hydroxynonanamide
CID 10039502
(2S)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883321
(2R)-2-(3-chlorophenyl)-2-hydroxynonanamide
CID 24883322
3-(3-Chlorophenyl)-3-hydroxypropanamide
CID 662123
3-(4-chlorophenyl)-N,3-dihydroxypropanamide
CID 72707667
2-(3-Chlorophenyl)-2-hydroxynon-8-enamide
CID 70682599
(4E)-2-(3-chlorophenyl)-2-hydroxy-5,9-dimethyldeca-4,8-dienamide
CID 70697237
3-(3,4-dichlorophenyl)-N,3-dihydroxy-N-methylpropanamide
CID 155546187
Propanamide, 3-(4-chlorophenyl)-3-hydroxy-
CID 548076

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dichlorophenyl)-3-hydroxypentanamide?
The IUPAC name of 3-(3,4-dichlorophenyl)-3-hydroxypentanamide (CID 10149274) is 3-(3,4-dichlorophenyl)-3-hydroxypentanamide.
What is the SMILES notation for 3-(3,4-dichlorophenyl)-3-hydroxypentanamide?
The canonical SMILES for 3-(3,4-dichlorophenyl)-3-hydroxypentanamide is CCC(O)(CC(N)=O)c1ccc(Cl)c(Cl)c1.
What is the InChIKey of 3-(3,4-dichlorophenyl)-3-hydroxypentanamide?
The InChIKey is QZTCVTHOJAQQCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO2/c1-2-11(16,6-10(14)15)7-3-4-8(12)9(13)5-7/h3-5,16H,2,6H2,1H3,(H2,14,15).
What are the key properties of 3-(3,4-dichlorophenyl)-3-hydroxypentanamide?
3-(3,4-dichlorophenyl)-3-hydroxypentanamide has a molecular weight of 262.14 g/mol, XLogP of 2.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dichlorophenyl)-3-hydroxypentanamide is sourced from PubChem (CID 10149274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).