5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide

C14H12Cl2N2O2 — CID 107183164

IUPAC5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2cc(N)cc(Cl)c2Cl)c1
InChIInChI=1S/C14H12Cl2N2O2/c1-20-10-4-2-3-9(7-10)18-14(19)11-5-8(17)6-12(15)13(11)16/h2-7H,17H2,1H3,(H,18,19)
InChIKeyGSJWXFJDJZARCM-UHFFFAOYSA-N
MW311.17 g/mol
LogP3.84
Rot. Bonds3

About 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide

5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide (PubChem CID 107183164) has the molecular formula C14H12Cl2N2O2 and a molecular weight of 311.17 g/mol. Its IUPAC name is 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide.

Molecular Properties

Compound Name5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide
PubChem CID107183164
Molecular FormulaC14H12Cl2N2O2
Molecular Weight311.17 g/mol
Exact Mass310.03
IUPAC Name5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide
SMILESCOc1cccc(NC(=O)c2cc(N)cc(Cl)c2Cl)c1
InChIInChI=1S/C14H12Cl2N2O2/c1-20-10-4-2-3-9(7-10)18-14(19)11-5-8(17)6-12(15)13(11)16/h2-7H,17H2,1H3,(H,18,19)
InChIKeyGSJWXFJDJZARCM-UHFFFAOYSA-N
XLogP3.84
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.17
LogP ≤ 53.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-amino-N-(2-bromo-5-methoxyphenyl)-2,3-dichlorobenzamide
CID 107185397
3-chloro-N-(3-methoxyphenyl)pyridine-4-carboxamide
CID 66462058
2-chloro-N-(3-methoxyphenyl)-4-methylbenzamide
CID 886020
3,6-dichloro-N-(3-methoxyphenyl)pyridazine-4-carboxamide
CID 6405267
2-amino-N-(3-methoxyphenyl)-5-methylbenzamide
CID 55069541
4-amino-N-(3-methoxyphenyl)-2,3-dimethylbenzamide
CID 68975139
5-chloro-4-iodo-2-methoxy-N-(3-methoxyphenyl)benzamide
CID 52577352
5-amino-N-(4-bromo-3-methylphenyl)-2,3-dichlorobenzamide
CID 107183354
4-amino-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 55041968
2-hydroxy-4-methoxy-N-(3-methoxyphenyl)benzamide
CID 27167303
5-amino-2,3-dichloro-N-(6-chloro-2-pyridinyl)benzamide
CID 107185680
N'-(4-amino-3-chlorophenyl)-N-(3-methoxyphenyl)oxamide
CID 108515975

Frequently Asked Questions

What is the IUPAC name of 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide?
The IUPAC name of 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide (CID 107183164) is 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide.
What is the SMILES notation for 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide?
The canonical SMILES for 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide is COc1cccc(NC(=O)c2cc(N)cc(Cl)c2Cl)c1.
What is the InChIKey of 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide?
The InChIKey is GSJWXFJDJZARCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O2/c1-20-10-4-2-3-9(7-10)18-14(19)11-5-8(17)6-12(15)13(11)16/h2-7H,17H2,1H3,(H,18,19).
What are the key properties of 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide?
5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide has a molecular weight of 311.17 g/mol, XLogP of 3.84, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2,3-dichloro-N-(3-methoxyphenyl)benzamide is sourced from PubChem (CID 107183164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).