4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide

C10H11Cl2NO2 — CID 114296442

IUPAC4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide
SMILESCC(Cl)CNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C10H11Cl2NO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,6,14H,5H2,1H3,(H,13,15)
InChIKeyJYMXUZGFWDWHHB-UHFFFAOYSA-N
MW248.11 g/mol
LogP2.40
Rot. Bonds3

About 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide

4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide (PubChem CID 114296442) has the molecular formula C10H11Cl2NO2 and a molecular weight of 248.11 g/mol. Its IUPAC name is 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide
PubChem CID114296442
Molecular FormulaC10H11Cl2NO2
Molecular Weight248.11 g/mol
Exact Mass247.02
IUPAC Name4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide
SMILESCC(Cl)CNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C10H11Cl2NO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,6,14H,5H2,1H3,(H,13,15)
InChIKeyJYMXUZGFWDWHHB-UHFFFAOYSA-N
XLogP2.40
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.11
LogP ≤ 52.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

4-chloro-2-hydroxy-N-(2-methylbutyl)benzamide
CID 62692259
4-chloro-2-hydroxy-N-(2-hydroxy-4-methylpentyl)benzamide
CID 103819904
2-[[(4-chloro-2-hydroxybenzoyl)amino]methyl]-3-methylbutanoic acid
CID 65220450
3-[[(4-chloro-2-hydroxybenzoyl)amino]methyl]-5-methylhexanoic acid
CID 65492259
N-(2-bromoethyl)-4-chloro-2-hydroxybenzamide
CID 114307488
4-chloro-N-(3-chloro-2,2-dimethylpropyl)-2-hydroxybenzamide
CID 115364597
4-chloro-N-[2-[ethyl(methyl)amino]ethyl]-2-hydroxybenzamide
CID 62634790
4-chloro-2-hydroxy-N-[(2-hydroxyphenyl)methyl]benzamide
CID 115598912
sodium;N-butyl-4-chloro-2-hydroxybenzamide;hydride
CID 174574548
4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide
CID 43090061
3-[(2,4-dichlorobenzoyl)amino]-2-methylpropanoic acid
CID 62676717
N-(2-bromoprop-2-enyl)-4-chloro-2-hydroxybenzamide
CID 115595089

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide?
The IUPAC name of 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide (CID 114296442) is 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide.
What is the SMILES notation for 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide?
The canonical SMILES for 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide is CC(Cl)CNC(=O)c1ccc(Cl)cc1O.
What is the InChIKey of 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide?
The InChIKey is JYMXUZGFWDWHHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NO2/c1-6(11)5-13-10(15)8-3-2-7(12)4-9(8)14/h2-4,6,14H,5H2,1H3,(H,13,15).
What are the key properties of 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide?
4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide has a molecular weight of 248.11 g/mol, XLogP of 2.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-chloropropyl)-2-hydroxybenzamide is sourced from PubChem (CID 114296442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).