N-(6-amino-3-pyridinyl)-3-chlorobenzamide

C12H10ClN3O — CID 62899569

IUPACN-(6-amino-3-pyridinyl)-3-chlorobenzamide
SMILESNc1ccc(NC(=O)c2cccc(Cl)c2)cn1
InChIInChI=1S/C12H10ClN3O/c13-9-3-1-2-8(6-9)12(17)16-10-4-5-11(14)15-7-10/h1-7H,(H2,14,15)(H,16,17)
InChIKeyIUTANEFJZKWBIO-UHFFFAOYSA-N
MW247.69 g/mol
LogP2.57
Rot. Bonds2

About N-(6-amino-3-pyridinyl)-3-chlorobenzamide

N-(6-amino-3-pyridinyl)-3-chlorobenzamide (PubChem CID 62899569) has the molecular formula C12H10ClN3O and a molecular weight of 247.69 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-3-chlorobenzamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-3-chlorobenzamide
PubChem CID62899569
Molecular FormulaC12H10ClN3O
Molecular Weight247.69 g/mol
Exact Mass247.05
IUPAC NameN-(6-amino-3-pyridinyl)-3-chlorobenzamide
SMILESNc1ccc(NC(=O)c2cccc(Cl)c2)cn1
InChIInChI=1S/C12H10ClN3O/c13-9-3-1-2-8(6-9)12(17)16-10-4-5-11(14)15-7-10/h1-7H,(H2,14,15)(H,16,17)
InChIKeyIUTANEFJZKWBIO-UHFFFAOYSA-N
XLogP2.57
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.69
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-[(3-chlorobenzoyl)amino]-2-pyridinyl]acetic acid
CID 107338354
3-chloro-N-[3-[(3-chlorobenzoyl)amino]phenyl]benzamide
CID 1369981
N-(6-amino-3-pyridinyl)-4-chloro-2-hydroxybenzamide
CID 55132975
N-(6-amino-3-pyridinyl)-3,4-dimethylbenzamide
CID 62899740
3-chloro-N-quinolin-3-ylbenzamide
CID 3284385
N-(6-amino-3-pyridinyl)-5-chloro-2-iodobenzamide
CID 113265570
N-(6-amino-3-pyridinyl)-2-bromo-4-chlorobenzamide
CID 103806405
3-chloro-N-[4-(hydrazinecarbonyl)phenyl]benzamide
CID 25219116
N-(6-amino-3-pyridinyl)-4-hydroxybenzamide
CID 62900503
3-chloro-N-(4-methylphenyl)benzamide
CID 722375
3-chloro-N-pyridin-4-ylbenzamide
CID 849128
N-[6-(butan-2-ylamino)-3-pyridinyl]-3-chlorobenzamide
CID 113009751

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-3-chlorobenzamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-3-chlorobenzamide (CID 62899569) is N-(6-amino-3-pyridinyl)-3-chlorobenzamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-3-chlorobenzamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-3-chlorobenzamide is Nc1ccc(NC(=O)c2cccc(Cl)c2)cn1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-3-chlorobenzamide?
The InChIKey is IUTANEFJZKWBIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClN3O/c13-9-3-1-2-8(6-9)12(17)16-10-4-5-11(14)15-7-10/h1-7H,(H2,14,15)(H,16,17).
What are the key properties of N-(6-amino-3-pyridinyl)-3-chlorobenzamide?
N-(6-amino-3-pyridinyl)-3-chlorobenzamide has a molecular weight of 247.69 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-3-chlorobenzamide is sourced from PubChem (CID 62899569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).