3-(2,4-dichlorophenyl)-N-hydroxypropanamide

C9H9Cl2NO2 — CID 11637231

IUPAC3-(2,4-dichlorophenyl)-N-hydroxypropanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)NO
InChIInChI=1S/C9H9Cl2NO2/c10-7-3-1-6(8(11)5-7)2-4-9(13)12-14/h1,3,5,14H,2,4H2,(H,12,13)
InChIKeyGADQEASLKRYAPQ-UHFFFAOYSA-N
MW234.08 g/mol
LogP2.43
Rot. Bonds3

About 3-(2,4-dichlorophenyl)-N-hydroxypropanamide

3-(2,4-dichlorophenyl)-N-hydroxypropanamide (PubChem CID 11637231) has the molecular formula C9H9Cl2NO2 and a molecular weight of 234.08 g/mol. Its IUPAC name is 3-(2,4-dichlorophenyl)-N-hydroxypropanamide.

Molecular Properties

Compound Name3-(2,4-dichlorophenyl)-N-hydroxypropanamide
PubChem CID11637231
Molecular FormulaC9H9Cl2NO2
Molecular Weight234.08 g/mol
Exact Mass233.00
IUPAC Name3-(2,4-dichlorophenyl)-N-hydroxypropanamide
SMILESO=C(CCc1ccc(Cl)cc1Cl)NO
InChIInChI=1S/C9H9Cl2NO2/c10-7-3-1-6(8(11)5-7)2-4-9(13)12-14/h1,3,5,14H,2,4H2,(H,12,13)
InChIKeyGADQEASLKRYAPQ-UHFFFAOYSA-N
XLogP2.43
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.08
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(2E)-3-(2,4-Dichlorophenyl)-N-hydroxyacrylamide
CID 11708451
2,4-Dichloro-N-hydroxybenzamide
CID 222876
2,2-bis(4-chlorophenyl)-N-hydroxyacetamide
CID 45482643
2-(4-Chlorophenyl)Acetamide
CID 643286
5-(4-chlorophenyl)-N-hydroxypentanamide
CID 11528707
2-(2-Chlorophenyl)acetamide
CID 641141
(3R)-3-(2,4-dichlorophenyl)-N,5-dihydroxypentanamide
CID 45105065
3-(2,6-Dichlorophenyl)glutaramide
CID 2732129
2-(4-chlorophenyl)-N-hydroxyacetamide
CID 23423499
2-(2,6-Dichlorophenyl)acetamide
CID 3422379
(S)-2-amino-3-(4-chlorophenyl)-N-hydroxypropanamide
CID 16094836
3-(2,4-dichlorophenyl)-N-hydroxyprop-2-ynamide
CID 11564864

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dichlorophenyl)-N-hydroxypropanamide?
The IUPAC name of 3-(2,4-dichlorophenyl)-N-hydroxypropanamide (CID 11637231) is 3-(2,4-dichlorophenyl)-N-hydroxypropanamide.
What is the SMILES notation for 3-(2,4-dichlorophenyl)-N-hydroxypropanamide?
The canonical SMILES for 3-(2,4-dichlorophenyl)-N-hydroxypropanamide is O=C(CCc1ccc(Cl)cc1Cl)NO.
What is the InChIKey of 3-(2,4-dichlorophenyl)-N-hydroxypropanamide?
The InChIKey is GADQEASLKRYAPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9Cl2NO2/c10-7-3-1-6(8(11)5-7)2-4-9(13)12-14/h1,3,5,14H,2,4H2,(H,12,13).
What are the key properties of 3-(2,4-dichlorophenyl)-N-hydroxypropanamide?
3-(2,4-dichlorophenyl)-N-hydroxypropanamide has a molecular weight of 234.08 g/mol, XLogP of 2.43, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dichlorophenyl)-N-hydroxypropanamide is sourced from PubChem (CID 11637231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).