2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide

C15H14Cl2N2O — CID 1479317

IUPAC2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide
SMILESCc1cccc(C)c1NC(=O)c1cc(Cl)cc(Cl)c1N
InChIInChI=1S/C15H14Cl2N2O/c1-8-4-3-5-9(2)14(8)19-15(20)11-6-10(16)7-12(17)13(11)18/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeySPWSUKSDKCJIBE-UHFFFAOYSA-N
MW309.20 g/mol
LogP4.44
Rot. Bonds2

About 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide

2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide (PubChem CID 1479317) has the molecular formula C15H14Cl2N2O and a molecular weight of 309.20 g/mol. Its IUPAC name is 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide.

Molecular Properties

Compound Name2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide
PubChem CID1479317
Molecular FormulaC15H14Cl2N2O
Molecular Weight309.20 g/mol
Exact Mass308.05
IUPAC Name2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide
SMILESCc1cccc(C)c1NC(=O)c1cc(Cl)cc(Cl)c1N
InChIInChI=1S/C15H14Cl2N2O/c1-8-4-3-5-9(2)14(8)19-15(20)11-6-10(16)7-12(17)13(11)18/h3-7H,18H2,1-2H3,(H,19,20)
InChIKeySPWSUKSDKCJIBE-UHFFFAOYSA-N
XLogP4.44
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.20
LogP ≤ 54.44
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-(2,6-dichlorophenyl)-3-methylbenzamide
CID 65468476
5-chloro-N-(2-chloro-6-methylphenyl)-2-fluorobenzamide
CID 66254946
N-(2-amino-6-methylphenyl)-5-chloro-2-hydroxybenzamide
CID 43330005
5-chloro-N-(2,6-dimethylphenyl)naphthalene-1-carboxamide
CID 2993699
2-amino-N-(2,6-dimethylphenyl)-5-methylbenzamide
CID 55083036
2,4-dichloro-N-(2-ethyl-6-methylphenyl)benzamide
CID 779360
2-amino-N-(2-chloro-6-methylphenyl)-4,5-difluorobenzamide
CID 66251998
1-(3,5-dichlorophenyl)-3-(2,6-dimethylphenyl)urea
CID 108991412
N-(2-amino-6-methylphenyl)-2-chloro-4-fluorobenzamide
CID 43330061
2-amino-5-methyl-N-(2,4,6-trichlorophenyl)benzamide
CID 62510533
N-(2-chloro-6-methylphenyl)-4-hydroxy-2-methylbenzamide
CID 103865613
N-(2-amino-6-chlorophenyl)-2-methylbenzamide
CID 62084781

Frequently Asked Questions

What is the IUPAC name of 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide?
The IUPAC name of 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide (CID 1479317) is 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide.
What is the SMILES notation for 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide?
The canonical SMILES for 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide is Cc1cccc(C)c1NC(=O)c1cc(Cl)cc(Cl)c1N.
What is the InChIKey of 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide?
The InChIKey is SPWSUKSDKCJIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O/c1-8-4-3-5-9(2)14(8)19-15(20)11-6-10(16)7-12(17)13(11)18/h3-7H,18H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide?
2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide has a molecular weight of 309.20 g/mol, XLogP of 4.44, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3,5-dichloro-N-(2,6-dimethylphenyl)benzamide is sourced from PubChem (CID 1479317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).