4-chloro-N-(2-methoxyethyl)benzamide

C10H12ClNO2 — CID 3457742

IUPAC4-chloro-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO2/c1-14-7-6-12-10(13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3,(H,12,13)
InChIKeyJCODKHOXBOVFBO-UHFFFAOYSA-N
MW213.66 g/mol
LogP1.72
Rot. Bonds4

About 4-chloro-N-(2-methoxyethyl)benzamide

4-chloro-N-(2-methoxyethyl)benzamide (PubChem CID 3457742) has the molecular formula C10H12ClNO2 and a molecular weight of 213.66 g/mol. Its IUPAC name is 4-chloro-N-(2-methoxyethyl)benzamide.

Molecular Properties

Compound Name4-chloro-N-(2-methoxyethyl)benzamide
PubChem CID3457742
Molecular FormulaC10H12ClNO2
Molecular Weight213.66 g/mol
Exact Mass213.06
IUPAC Name4-chloro-N-(2-methoxyethyl)benzamide
SMILESCOCCNC(=O)c1ccc(Cl)cc1
InChIInChI=1S/C10H12ClNO2/c1-14-7-6-12-10(13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3,(H,12,13)
InChIKeyJCODKHOXBOVFBO-UHFFFAOYSA-N
XLogP1.72
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.66
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-chloro-N-(2-methoxyethyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(4-chlorobenzoyl)amino]-3-(2-methoxyethyl)urea
CID 47133922
methyl 4-[2-[(4-chlorobenzoyl)amino]ethoxy]benzoate
CID 14097617
4-N-(4-chlorophenyl)-1-N-(3-methoxypropyl)benzene-1,4-dicarboxamide
CID 109045341
4-N-(5-chloro-2-methoxyphenyl)-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 109045180
4-[2-(4-chlorophenoxy)propanoylamino]-N-(2-methoxyethyl)benzamide
CID 17218257
N-[2-(4-chlorophenoxy)ethyl]-4-(2-methoxyethylsulfamoyl)benzamide
CID 34190671
4-chloro-N-[8-[(4-chlorobenzoyl)amino]octyl]benzamide
CID 3606775
4-N-tert-butyl-1-N-(2-methoxyethyl)benzene-1,4-dicarboxamide
CID 47437380
4-chloro-N-(2-chloro-3-methoxypropyl)benzamide
CID 114298950
N-(2-methoxyethyl)-4-(3-methylpentan-3-yl)benzamide
CID 70934716
4-(4-aminophenyl)-N-(2-methoxyethyl)benzamide
CID 91665664
2-[(4-chlorobenzoyl)amino]ethylcarbamic acid
CID 19741762

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-(2-methoxyethyl)benzamide?
The IUPAC name of 4-chloro-N-(2-methoxyethyl)benzamide (CID 3457742) is 4-chloro-N-(2-methoxyethyl)benzamide.
What is the SMILES notation for 4-chloro-N-(2-methoxyethyl)benzamide?
The canonical SMILES for 4-chloro-N-(2-methoxyethyl)benzamide is COCCNC(=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-(2-methoxyethyl)benzamide?
The InChIKey is JCODKHOXBOVFBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClNO2/c1-14-7-6-12-10(13)8-2-4-9(11)5-3-8/h2-5H,6-7H2,1H3,(H,12,13).
What are the key properties of 4-chloro-N-(2-methoxyethyl)benzamide?
4-chloro-N-(2-methoxyethyl)benzamide has a molecular weight of 213.66 g/mol, XLogP of 1.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-(2-methoxyethyl)benzamide is sourced from PubChem (CID 3457742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).