N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide

C12H11N3O — CID 46307927

IUPACN-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccnc(NC(=O)c2ccccn2)c1
InChIInChI=1S/C12H11N3O/c1-9-5-7-14-11(8-9)15-12(16)10-4-2-3-6-13-10/h2-8H,1H3,(H,14,15,16)
InChIKeyPONBMLPGDXRWTL-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.04
Rot. Bonds2

About N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide

N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide (PubChem CID 46307927) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
PubChem CID46307927
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC NameN-(4-methyl-2-pyridinyl)pyridine-2-carboxamide
SMILESCc1ccnc(NC(=O)c2ccccn2)c1
InChIInChI=1S/C12H11N3O/c1-9-5-7-14-11(8-9)15-12(16)10-4-2-3-6-13-10/h2-8H,1H3,(H,14,15,16)
InChIKeyPONBMLPGDXRWTL-UHFFFAOYSA-N
XLogP2.04
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide?
The IUPAC name of N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide (CID 46307927) is N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide?
The canonical SMILES for N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide is Cc1ccnc(NC(=O)c2ccccn2)c1.
What is the InChIKey of N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide?
The InChIKey is PONBMLPGDXRWTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-9-5-7-14-11(8-9)15-12(16)10-4-2-3-6-13-10/h2-8H,1H3,(H,14,15,16).
What are the key properties of N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide?
N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide has a molecular weight of 213.24 g/mol, XLogP of 2.04, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-2-pyridinyl)pyridine-2-carboxamide is sourced from PubChem (CID 46307927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).