2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide

C12H9Cl2N3O — CID 114052162

IUPAC2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide
SMILESNc1cccc(Cl)c1C(=O)Nc1cc(Cl)ccn1
InChIInChI=1S/C12H9Cl2N3O/c13-7-4-5-16-10(6-7)17-12(18)11-8(14)2-1-3-9(11)15/h1-6H,15H2,(H,16,17,18)
InChIKeyRDIMHJRBJCMUSX-UHFFFAOYSA-N
MW282.13 g/mol
LogP3.22
Rot. Bonds2

About 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide

2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide (PubChem CID 114052162) has the molecular formula C12H9Cl2N3O and a molecular weight of 282.13 g/mol. Its IUPAC name is 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide.

Molecular Properties

Compound Name2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide
PubChem CID114052162
Molecular FormulaC12H9Cl2N3O
Molecular Weight282.13 g/mol
Exact Mass281.01
IUPAC Name2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide
SMILESNc1cccc(Cl)c1C(=O)Nc1cc(Cl)ccn1
InChIInChI=1S/C12H9Cl2N3O/c13-7-4-5-16-10(6-7)17-12(18)11-8(14)2-1-3-9(11)15/h1-6H,15H2,(H,16,17,18)
InChIKeyRDIMHJRBJCMUSX-UHFFFAOYSA-N
XLogP3.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.13
LogP ≤ 53.22
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

2-amino-N-(4-chloro-2-pyridinyl)benzamide
CID 103950182
2-amino-6-chloro-N-pyridazin-3-ylbenzamide
CID 116785965
3-chloro-N-(4-chloro-2-pyridinyl)benzamide
CID 3011465
N-(2-aminopyrimidin-4-yl)-2,6-dichlorobenzamide
CID 59618305
2-amino-N-(4-chloro-2-pyridinyl)-5-fluorobenzamide
CID 114052160
2-amino-6-chloro-N-(3,4-difluorophenyl)benzamide
CID 63660522
N-(4-chloro-2-pyridinyl)-3-hydroxypyridine-2-carboxamide
CID 104820977
2-amino-6-chloro-N-(5-chloro-2-methoxyphenyl)benzamide
CID 63659121
5-chloro-N-(4-chloro-2-pyridinyl)-2-fluorobenzamide
CID 113236117
2-amino-6-chloro-N-(2,4,6-trimethylphenyl)benzamide
CID 63659648
2-amino-6-chloro-N-(3,4,5-trifluorophenyl)benzamide
CID 63658626
N-(4-chloro-2-pyridinyl)-3-(trifluoromethyl)benzamide
CID 115626766

Frequently Asked Questions

What is the IUPAC name of 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide?
The IUPAC name of 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide (CID 114052162) is 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide.
What is the SMILES notation for 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide?
The canonical SMILES for 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide is Nc1cccc(Cl)c1C(=O)Nc1cc(Cl)ccn1.
What is the InChIKey of 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide?
The InChIKey is RDIMHJRBJCMUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2N3O/c13-7-4-5-16-10(6-7)17-12(18)11-8(14)2-1-3-9(11)15/h1-6H,15H2,(H,16,17,18).
What are the key properties of 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide?
2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide has a molecular weight of 282.13 g/mol, XLogP of 3.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-chloro-N-(4-chloro-2-pyridinyl)benzamide is sourced from PubChem (CID 114052162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).