3-chloro-5-[(2-phenoxyacetyl)amino]benzamide

C15H13ClN2O3 — CID 154872841

IUPAC3-chloro-5-[(2-phenoxyacetyl)amino]benzamide
SMILESNC(=O)c1cc(Cl)cc(NC(=O)COc2ccccc2)c1
InChIInChI=1S/C15H13ClN2O3/c16-11-6-10(15(17)20)7-12(8-11)18-14(19)9-21-13-4-2-1-3-5-13/h1-8H,9H2,(H2,17,20)(H,18,19)
InChIKeyOPDHSQGCCKQSOL-UHFFFAOYSA-N
MW304.73 g/mol
LogP2.46
Rot. Bonds5

About 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide

3-chloro-5-[(2-phenoxyacetyl)amino]benzamide (PubChem CID 154872841) has the molecular formula C15H13ClN2O3 and a molecular weight of 304.73 g/mol. Its IUPAC name is 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide.

Molecular Properties

Compound Name3-chloro-5-[(2-phenoxyacetyl)amino]benzamide
PubChem CID154872841
Molecular FormulaC15H13ClN2O3
Molecular Weight304.73 g/mol
Exact Mass304.06
IUPAC Name3-chloro-5-[(2-phenoxyacetyl)amino]benzamide
SMILESNC(=O)c1cc(Cl)cc(NC(=O)COc2ccccc2)c1
InChIInChI=1S/C15H13ClN2O3/c16-11-6-10(15(17)20)7-12(8-11)18-14(19)9-21-13-4-2-1-3-5-13/h1-8H,9H2,(H2,17,20)(H,18,19)
InChIKeyOPDHSQGCCKQSOL-UHFFFAOYSA-N
XLogP2.46
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.73
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
N-(3,5-dichlorophenyl)-2-(4-phenylmethoxyphenoxy)acetamide
CID 7926056
N-[(3,5-dichlorophenyl)carbamothioyl]-2-phenoxyacetamide
CID 1014402
ethyl 3,5-bis[(2-phenoxyacetyl)amino]benzoate
CID 15008323
5-[2-(3,5-dichloroanilino)-2-oxoethoxy]benzene-1,3-dicarboxylic acid
CID 99989520
N-(3,5-dichlorophenyl)-3-phenoxypropanamide
CID 26591488
N-(3-chloro-4-fluorophenyl)-2-phenoxyacetamide
CID 924892
N-[4-(carbamothioylamino)phenyl]-2-phenoxyacetamide
CID 169359471
N-[3-(aminomethyl)phenyl]-2-phenoxyacetamide
CID 16781265
2-(4-acetylphenoxy)-N-(3-chlorophenyl)acetamide
CID 2709970
N-[3-[2-(3,5-dichloroanilino)-2-oxoethoxy]phenyl]-2,2-dimethylpropanamide
CID 18870351
N-[4-[2-(3-chloroanilino)-2-oxoethyl]sulfanylphenyl]-2-phenoxyacetamide
CID 22778580

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide?
The IUPAC name of 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide (CID 154872841) is 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide.
What is the SMILES notation for 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide?
The canonical SMILES for 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide is NC(=O)c1cc(Cl)cc(NC(=O)COc2ccccc2)c1.
What is the InChIKey of 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide?
The InChIKey is OPDHSQGCCKQSOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN2O3/c16-11-6-10(15(17)20)7-12(8-11)18-14(19)9-21-13-4-2-1-3-5-13/h1-8H,9H2,(H2,17,20)(H,18,19).
What are the key properties of 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide?
3-chloro-5-[(2-phenoxyacetyl)amino]benzamide has a molecular weight of 304.73 g/mol, XLogP of 2.46, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-[(2-phenoxyacetyl)amino]benzamide is sourced from PubChem (CID 154872841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).