2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide

C14H12Cl2N2O — CID 65468476

IUPAC2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2c(Cl)cccc2Cl)c1N
InChIInChI=1S/C14H12Cl2N2O/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,17H2,1H3,(H,18,19)
InChIKeyQVRSRDMYLMEOKR-UHFFFAOYSA-N
MW295.17 g/mol
LogP4.14
Rot. Bonds2

About 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide

2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide (PubChem CID 65468476) has the molecular formula C14H12Cl2N2O and a molecular weight of 295.17 g/mol. Its IUPAC name is 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide
PubChem CID65468476
Molecular FormulaC14H12Cl2N2O
Molecular Weight295.17 g/mol
Exact Mass294.03
IUPAC Name2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2c(Cl)cccc2Cl)c1N
InChIInChI=1S/C14H12Cl2N2O/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,17H2,1H3,(H,18,19)
InChIKeyQVRSRDMYLMEOKR-UHFFFAOYSA-N
XLogP4.14
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.17
LogP ≤ 54.14
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

N-(2-amino-6-chlorophenyl)-2-methylbenzamide
CID 62084781
2-bromo-N-(2,6-dichlorophenyl)-3-methylbenzamide
CID 114023836
2-amino-N-(2-chloro-4,6-difluorophenyl)-3-methylbenzamide
CID 83081775
3-chloro-2-[(2-methylbenzoyl)amino]benzoic acid
CID 23208226
2-amino-N-(2,5-dichloro-4-methylphenyl)-3-methylbenzamide
CID 104725699
2-amino-N-(4-bromo-2-chlorophenyl)-3-methylbenzamide
CID 43347143
2-amino-3-chloro-N-(2,6-dibromo-4-methylphenyl)benzamide
CID 115540020
5-chloro-N-(2,6-dimethylphenyl)naphthalene-1-carboxamide
CID 2993699
N-(2-amino-6-chlorophenyl)-3-hydroxy-2-methylbenzamide
CID 82827421
2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide
CID 1479317
2-amino-3-chloro-N-(3-methyl-2-pyridinyl)benzamide
CID 115539994
2-amino-N-(2-chloro-6-methylphenyl)-4,5-difluorobenzamide
CID 66251998

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide?
The IUPAC name of 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide (CID 65468476) is 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide.
What is the SMILES notation for 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide?
The canonical SMILES for 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide is Cc1cccc(C(=O)Nc2c(Cl)cccc2Cl)c1N.
What is the InChIKey of 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide?
The InChIKey is QVRSRDMYLMEOKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12Cl2N2O/c1-8-4-2-5-9(12(8)17)14(19)18-13-10(15)6-3-7-11(13)16/h2-7H,17H2,1H3,(H,18,19).
What are the key properties of 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide?
2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide has a molecular weight of 295.17 g/mol, XLogP of 4.14, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-dichlorophenyl)-3-methylbenzamide is sourced from PubChem (CID 65468476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).