2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide

C13H12N6O — CID 75430489

IUPAC2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide
SMILESCc1cnc(NC(=O)c2ccnc(-n3ccnc3)c2)[nH]1
InChIInChI=1S/C13H12N6O/c1-9-7-16-13(17-9)18-12(20)10-2-3-15-11(6-10)19-5-4-14-8-19/h2-8H,1H3,(H2,16,17,18,20)
InChIKeyHYQCJLNTKACWLE-UHFFFAOYSA-N
MW268.28 g/mol
LogP1.55
Rot. Bonds3

About 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide

2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide (PubChem CID 75430489) has the molecular formula C13H12N6O and a molecular weight of 268.28 g/mol. Its IUPAC name is 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide
PubChem CID75430489
Molecular FormulaC13H12N6O
Molecular Weight268.28 g/mol
Exact Mass268.11
IUPAC Name2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide
SMILESCc1cnc(NC(=O)c2ccnc(-n3ccnc3)c2)[nH]1
InChIInChI=1S/C13H12N6O/c1-9-7-16-13(17-9)18-12(20)10-2-3-15-11(6-10)19-5-4-14-8-19/h2-8H,1H3,(H2,16,17,18,20)
InChIKeyHYQCJLNTKACWLE-UHFFFAOYSA-N
XLogP1.55
TPSA88.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethylphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 87010836
2-imidazol-1-yl-N-(3-methyl-2H-indazol-6-yl)pyridine-4-carboxamide
CID 75439961
N-(4-chloro-2-hydroxyphenyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 75432250
2-imidazol-1-yl-N-[3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]pyridine-4-carboxamide
CID 136528207
N-(1-hydroxypentan-3-yl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 109478737
N-(4-methylphenyl)-2-(1,2,4-triazol-4-yl)pyridine-4-carboxamide
CID 39890492
2-imidazol-1-yl-N-(2-methylpiperidin-4-yl)pyridine-4-carboxamide;dihydrochloride
CID 120598171
N-(3-hydroxy-2,2,4-trimethylpentyl)-2-imidazol-1-ylpyridine-4-carboxamide
CID 109380562
N-[4-(diethylamino)-4-oxobutyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 51090160
2-imidazol-1-yl-N-[4-[(3-methylpiperidin-1-yl)methyl]phenyl]pyridine-4-carboxamide
CID 87045978
2-imidazol-1-yl-N-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]pyridine-4-carboxamide
CID 51085856
N-[(5-acetyl-6-methyl-2-pyridinyl)methyl]-2-imidazol-1-ylpyridine-4-carboxamide
CID 84594593

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide?
The IUPAC name of 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide (CID 75430489) is 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide.
What is the SMILES notation for 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide?
The canonical SMILES for 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide is Cc1cnc(NC(=O)c2ccnc(-n3ccnc3)c2)[nH]1.
What is the InChIKey of 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide?
The InChIKey is HYQCJLNTKACWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N6O/c1-9-7-16-13(17-9)18-12(20)10-2-3-15-11(6-10)19-5-4-14-8-19/h2-8H,1H3,(H2,16,17,18,20).
What are the key properties of 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide?
2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide has a molecular weight of 268.28 g/mol, XLogP of 1.55, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-N-(5-methyl-1H-imidazol-2-yl)pyridine-4-carboxamide is sourced from PubChem (CID 75430489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).