3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide

C16H15ClN2O3 — CID 46879470

IUPAC3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
SMILESCOCC(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1
InChIInChI=1S/C16H15ClN2O3/c1-22-10-15(20)18-13-6-3-7-14(9-13)19-16(21)11-4-2-5-12(17)8-11/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyPSQLPTUXUAHHKZ-UHFFFAOYSA-N
MW318.76 g/mol
LogP3.18
Rot. Bonds5

About 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide

3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide (PubChem CID 46879470) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide.

Molecular Properties

Compound Name3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
PubChem CID46879470
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
SMILESCOCC(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1
InChIInChI=1S/C16H15ClN2O3/c1-22-10-15(20)18-13-6-3-7-14(9-13)19-16(21)11-4-2-5-12(17)8-11/h2-9H,10H2,1H3,(H,18,20)(H,19,21)
InChIKeyPSQLPTUXUAHHKZ-UHFFFAOYSA-N
XLogP3.18
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
N-(3-acetamidophenyl)-3-chlorobenzamide
CID 669190
2-benzamido-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 46579689
3-chloro-N-(3-methylphenyl)benzamide
CID 722373
tert-butyl N-[2-[3-[(3-chlorobenzoyl)amino]anilino]-2-oxoethyl]carbamate
CID 108917112
N-tert-butyl-3-[(2-methoxyacetyl)amino]benzamide
CID 47251267
5-bromo-N-[3-[(2-methoxyacetyl)amino]phenyl]thiophene-3-carboxamide
CID 39862378
3-chloro-N-[3-(2,2-dimethylpropanoylamino)phenyl]benzamide
CID 17102477
3-chloro-N-[4-[[2-(4-methylphenoxy)acetyl]amino]phenyl]benzamide
CID 4674584
4-(4-chloro-2-nitrophenoxy)-3-methoxy-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide
CID 55566996
2-methoxyethyl 4-[(3-chlorobenzoyl)amino]benzoate
CID 19169303
2-[3-[(3-chlorobenzoyl)amino]phenoxy]acetic acid
CID 61058711

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The IUPAC name of 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide (CID 46879470) is 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide.
What is the SMILES notation for 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The canonical SMILES for 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide is COCC(=O)Nc1cccc(NC(=O)c2cccc(Cl)c2)c1.
What is the InChIKey of 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
The InChIKey is PSQLPTUXUAHHKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c1-22-10-15(20)18-13-6-3-7-14(9-13)19-16(21)11-4-2-5-12(17)8-11/h2-9H,10H2,1H3,(H,18,20)(H,19,21).
What are the key properties of 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide?
3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide has a molecular weight of 318.76 g/mol, XLogP of 3.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-[3-[(2-methoxyacetyl)amino]phenyl]benzamide is sourced from PubChem (CID 46879470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).