2-amino-N-(2-chlorophenyl)-6-methylbenzamide

C14H13ClN2O — CID 16785685

IUPAC2-amino-N-(2-chlorophenyl)-6-methylbenzamide
SMILESCc1cccc(N)c1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-5-4-7-11(16)13(9)14(18)17-12-8-3-2-6-10(12)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyCTRTVLYAQBPGAI-UHFFFAOYSA-N
MW260.72 g/mol
LogP3.48
Rot. Bonds2

About 2-amino-N-(2-chlorophenyl)-6-methylbenzamide

2-amino-N-(2-chlorophenyl)-6-methylbenzamide (PubChem CID 16785685) has the molecular formula C14H13ClN2O and a molecular weight of 260.72 g/mol. Its IUPAC name is 2-amino-N-(2-chlorophenyl)-6-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(2-chlorophenyl)-6-methylbenzamide
PubChem CID16785685
Molecular FormulaC14H13ClN2O
Molecular Weight260.72 g/mol
Exact Mass260.07
IUPAC Name2-amino-N-(2-chlorophenyl)-6-methylbenzamide
SMILESCc1cccc(N)c1C(=O)Nc1ccccc1Cl
InChIInChI=1S/C14H13ClN2O/c1-9-5-4-7-11(16)13(9)14(18)17-12-8-3-2-6-10(12)15/h2-8H,16H2,1H3,(H,17,18)
InChIKeyCTRTVLYAQBPGAI-UHFFFAOYSA-N
XLogP3.48
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.72
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-amino-N-(2-chloro-5-fluorophenyl)-6-methylbenzamide
CID 107526569
2-amino-6-methyl-N-[2-(methylcarbamoyl)phenyl]benzamide
CID 43574320
2-amino-N-(2-cyanophenyl)-6-methylbenzamide
CID 16781189
2-amino-6-chloro-N-(3-fluoro-2-methylphenyl)benzamide
CID 63660223
2,3-diamino-N-(2-chlorophenyl)benzamide
CID 175375974
2-amino-6-methoxy-N-(2-methylphenyl)benzamide
CID 81410704
2-amino-6-chloro-N-(3-methyl-4-pyridinyl)benzamide
CID 63669500
5-amino-N-(2-chlorophenyl)-3-methyl-1,2-oxazole-4-carboxamide
CID 10824661
2-amino-6-methylbenzohydrazide;ethane
CID 145125009
2-amino-6-methyl-N-(4-propan-2-ylphenyl)benzamide
CID 18069728
2-amino-6-chloro-N-(2,4,6-trimethylphenyl)benzamide
CID 63659648
2-amino-6-chloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 63659820

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2-chlorophenyl)-6-methylbenzamide?
The IUPAC name of 2-amino-N-(2-chlorophenyl)-6-methylbenzamide (CID 16785685) is 2-amino-N-(2-chlorophenyl)-6-methylbenzamide.
What is the SMILES notation for 2-amino-N-(2-chlorophenyl)-6-methylbenzamide?
The canonical SMILES for 2-amino-N-(2-chlorophenyl)-6-methylbenzamide is Cc1cccc(N)c1C(=O)Nc1ccccc1Cl.
What is the InChIKey of 2-amino-N-(2-chlorophenyl)-6-methylbenzamide?
The InChIKey is CTRTVLYAQBPGAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O/c1-9-5-4-7-11(16)13(9)14(18)17-12-8-3-2-6-10(12)15/h2-8H,16H2,1H3,(H,17,18).
What are the key properties of 2-amino-N-(2-chlorophenyl)-6-methylbenzamide?
2-amino-N-(2-chlorophenyl)-6-methylbenzamide has a molecular weight of 260.72 g/mol, XLogP of 3.48, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2-chlorophenyl)-6-methylbenzamide is sourced from PubChem (CID 16785685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).