N-(5-amino-6-methyl-2-pyridinyl)benzamide

C13H13N3O — CID 82330924

IUPACN-(5-amino-6-methyl-2-pyridinyl)benzamide
SMILESCc1nc(NC(=O)c2ccccc2)ccc1N
InChIInChI=1S/C13H13N3O/c1-9-11(14)7-8-12(15-9)16-13(17)10-5-3-2-4-6-10/h2-8H,14H2,1H3,(H,15,16,17)
InChIKeyUCSOJBAIUOBDIS-UHFFFAOYSA-N
MW227.27 g/mol
LogP2.22
Rot. Bonds2

About N-(5-amino-6-methyl-2-pyridinyl)benzamide

N-(5-amino-6-methyl-2-pyridinyl)benzamide (PubChem CID 82330924) has the molecular formula C13H13N3O and a molecular weight of 227.27 g/mol. Its IUPAC name is N-(5-amino-6-methyl-2-pyridinyl)benzamide.

Molecular Properties

Compound NameN-(5-amino-6-methyl-2-pyridinyl)benzamide
PubChem CID82330924
Molecular FormulaC13H13N3O
Molecular Weight227.27 g/mol
Exact Mass227.11
IUPAC NameN-(5-amino-6-methyl-2-pyridinyl)benzamide
SMILESCc1nc(NC(=O)c2ccccc2)ccc1N
InChIInChI=1S/C13H13N3O/c1-9-11(14)7-8-12(15-9)16-13(17)10-5-3-2-4-6-10/h2-8H,14H2,1H3,(H,15,16,17)
InChIKeyUCSOJBAIUOBDIS-UHFFFAOYSA-N
XLogP2.22
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.27
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-6-methyl-2-pyridinyl)benzamide?
The IUPAC name of N-(5-amino-6-methyl-2-pyridinyl)benzamide (CID 82330924) is N-(5-amino-6-methyl-2-pyridinyl)benzamide.
What is the SMILES notation for N-(5-amino-6-methyl-2-pyridinyl)benzamide?
The canonical SMILES for N-(5-amino-6-methyl-2-pyridinyl)benzamide is Cc1nc(NC(=O)c2ccccc2)ccc1N.
What is the InChIKey of N-(5-amino-6-methyl-2-pyridinyl)benzamide?
The InChIKey is UCSOJBAIUOBDIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-9-11(14)7-8-12(15-9)16-13(17)10-5-3-2-4-6-10/h2-8H,14H2,1H3,(H,15,16,17).
What are the key properties of N-(5-amino-6-methyl-2-pyridinyl)benzamide?
N-(5-amino-6-methyl-2-pyridinyl)benzamide has a molecular weight of 227.27 g/mol, XLogP of 2.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-6-methyl-2-pyridinyl)benzamide is sourced from PubChem (CID 82330924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).