N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide

C15H15ClN2O2 — CID 70635725

IUPACN-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide
SMILESCOc1cc(NC(=O)c2ccccc2Cl)c(C)cc1N
InChIInChI=1S/C15H15ClN2O2/c1-9-7-12(17)14(20-2)8-13(9)18-15(19)10-5-3-4-6-11(10)16/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyAONNJSHLZQLYJR-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.49
Rot. Bonds3

About N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide

N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide (PubChem CID 70635725) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide.

Molecular Properties

Compound NameN-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide
PubChem CID70635725
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide
SMILESCOc1cc(NC(=O)c2ccccc2Cl)c(C)cc1N
InChIInChI=1S/C15H15ClN2O2/c1-9-7-12(17)14(20-2)8-13(9)18-15(19)10-5-3-4-6-11(10)16/h3-8H,17H2,1-2H3,(H,18,19)
InChIKeyAONNJSHLZQLYJR-UHFFFAOYSA-N
XLogP3.49
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.49
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

N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide
CID 103144625
N-(3-amino-4-methoxyphenyl)-2-chlorobenzamide
CID 23464385
N-(2-amino-4,5-dimethylphenyl)-3-chloro-2-methylbenzamide
CID 107095769
2-chloro-N-(2,4-dimethoxyphenyl)benzamide
CID 722324
4-amino-2-chloro-5-methoxy-N-phenylbenzamide
CID 66664690
N-(2-chlorophenyl)-2,4,5-trimethoxybenzamide
CID 912702
2-chloro-N-[4-[4-[(2-chlorobenzoyl)amino]-3-methylphenyl]-2-methylphenyl]benzamide
CID 2313060
N-(5-amino-2,4-dimethylphenyl)-4-chloro-2-methoxybenzamide
CID 104756975
2-amino-4,5-dimethoxy-N-(2-methylphenyl)benzamide
CID 14127147
N-(4-amino-5-chloro-2-methylphenyl)-2-fluoro-3-methylbenzamide
CID 104667416
N-(2-aminophenyl)-2-chlorobenzamide
CID 684680
2-amino-6-chloro-N-(4-chloro-2-methoxy-5-methylphenyl)benzamide
CID 63658199

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide?
The IUPAC name of N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide (CID 70635725) is N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide.
What is the SMILES notation for N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide?
The canonical SMILES for N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide is COc1cc(NC(=O)c2ccccc2Cl)c(C)cc1N.
What is the InChIKey of N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide?
The InChIKey is AONNJSHLZQLYJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-9-7-12(17)14(20-2)8-13(9)18-15(19)10-5-3-4-6-11(10)16/h3-8H,17H2,1-2H3,(H,18,19).
What are the key properties of N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide?
N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide has a molecular weight of 290.75 g/mol, XLogP of 3.49, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-5-methoxy-2-methylphenyl)-2-chlorobenzamide is sourced from PubChem (CID 70635725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).