4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide

C11H14ClNO3 — CID 43090061

IUPAC4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C11H14ClNO3/c1-16-6-2-5-13-11(15)9-4-3-8(12)7-10(9)14/h3-4,7,14H,2,5-6H2,1H3,(H,13,15)
InChIKeyPLHBBPKIHJAWES-UHFFFAOYSA-N
MW243.69 g/mol
LogP1.81
Rot. Bonds5

About 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide

4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide (PubChem CID 43090061) has the molecular formula C11H14ClNO3 and a molecular weight of 243.69 g/mol. Its IUPAC name is 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide
PubChem CID43090061
Molecular FormulaC11H14ClNO3
Molecular Weight243.69 g/mol
Exact Mass243.07
IUPAC Name4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccc(Cl)cc1O
InChIInChI=1S/C11H14ClNO3/c1-16-6-2-5-13-11(15)9-4-3-8(12)7-10(9)14/h3-4,7,14H,2,5-6H2,1H3,(H,13,15)
InChIKeyPLHBBPKIHJAWES-UHFFFAOYSA-N
XLogP1.81
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.69
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-hydroxy-4-methoxy-N-(3-methoxypropyl)benzamide
CID 43090058
sodium;N-butyl-4-chloro-2-hydroxybenzamide;hydride
CID 174574548
4-chloro-2-hydroxy-N-(3-hydroxy-4-methoxybutyl)benzamide
CID 113343606
4-chloro-2-hydroxy-N-[2-(2-methoxyethylamino)-2-oxoethyl]benzamide
CID 115577293
4-chloro-N-[3-(cyclopropylmethoxy)propyl]-2-hydroxybenzamide
CID 103606116
2-bromo-4-chloro-N-(4-methoxybutyl)benzamide
CID 103763962
4-chloro-2-hydroxy-N-(5-iodopentyl)benzamide
CID 107322316
N-(2-bromoethyl)-4-chloro-2-hydroxybenzamide
CID 114307488
2-hydroxy-4-methoxy-N-[3-(2-methoxyethoxy)propyl]benzamide
CID 103604676
4-chloro-N-[2-(2,2-difluoroethoxy)ethyl]-2-hydroxybenzamide
CID 103097023
4-chloro-N-[2-[ethyl(methyl)amino]ethyl]-2-hydroxybenzamide
CID 62634790
4-chloro-N-(2-cyclopentyloxyethyl)-2-hydroxybenzamide
CID 55151514

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide?
The IUPAC name of 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide (CID 43090061) is 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide is COCCCNC(=O)c1ccc(Cl)cc1O.
What is the InChIKey of 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide?
The InChIKey is PLHBBPKIHJAWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClNO3/c1-16-6-2-5-13-11(15)9-4-3-8(12)7-10(9)14/h3-4,7,14H,2,5-6H2,1H3,(H,13,15).
What are the key properties of 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide?
4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide has a molecular weight of 243.69 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-hydroxy-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 43090061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).