2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide

C15H15ClN2O — CID 62003309

IUPAC2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(N(C)C(=O)c2cc(Cl)ccc2N)c1
InChIInChI=1S/C15H15ClN2O/c1-10-4-3-5-12(8-10)18(2)15(19)13-9-11(16)6-7-14(13)17/h3-9H,17H2,1-2H3
InChIKeySEVOOEHQDRBBPH-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.51
Rot. Bonds2

About 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide

2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide (PubChem CID 62003309) has the molecular formula C15H15ClN2O and a molecular weight of 274.75 g/mol. Its IUPAC name is 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide
PubChem CID62003309
Molecular FormulaC15H15ClN2O
Molecular Weight274.75 g/mol
Exact Mass274.09
IUPAC Name2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide
SMILESCc1cccc(N(C)C(=O)c2cc(Cl)ccc2N)c1
InChIInChI=1S/C15H15ClN2O/c1-10-4-3-5-12(8-10)18(2)15(19)13-9-11(16)6-7-14(13)17/h3-9H,17H2,1-2H3
InChIKeySEVOOEHQDRBBPH-UHFFFAOYSA-N
XLogP3.51
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-amino-2-fluoro-N-methyl-N-(3-methylphenyl)benzamide
CID 62002180
2-amino-5-hydroxy-N-(3-hydroxyphenyl)-N-methylbenzamide
CID 107733144
2-amino-5-bromo-N-methyl-N-(3-methylphenyl)pyridine-3-carboxamide
CID 62160905
N,2-dimethyl-N-(3-methylphenyl)benzamide;ethane
CID 91376275
2,4-dibromo-N-methyl-N-(3-methylphenyl)benzamide
CID 107952311
2,5-dihydroxy-N-methyl-N-(3-methylphenyl)benzamide
CID 103892363
2-amino-N-(3,5-dimethylphenyl)-5-fluoro-N-methylbenzamide
CID 62002165
1-[2-amino-5-(N,3-dimethylanilino)phenyl]ethanone
CID 104612683
3-bromo-4-fluoro-N-methyl-N-(3-methylphenyl)benzamide
CID 113244776
2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzenesulfonamide
CID 62002038
2-amino-N-(3-fluorophenyl)-5-hydroxy-N-methylbenzamide
CID 107075081
2-bromo-N-(3-carbamothioylphenyl)-4-chloro-N-methylbenzamide
CID 107987798

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide?
The IUPAC name of 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide (CID 62003309) is 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide?
The canonical SMILES for 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide is Cc1cccc(N(C)C(=O)c2cc(Cl)ccc2N)c1.
What is the InChIKey of 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide?
The InChIKey is SEVOOEHQDRBBPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O/c1-10-4-3-5-12(8-10)18(2)15(19)13-9-11(16)6-7-14(13)17/h3-9H,17H2,1-2H3.
What are the key properties of 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide?
2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide has a molecular weight of 274.75 g/mol, XLogP of 3.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-chloro-N-methyl-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 62003309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).