N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide

C9H9N5O — CID 78928131

IUPACN-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
SMILESCc1nc(NC(=O)c2cccnc2)n[nH]1
InChIInChI=1S/C9H9N5O/c1-6-11-9(14-13-6)12-8(15)7-3-2-4-10-5-7/h2-5H,1H3,(H2,11,12,13,14,15)
InChIKeyXZLDCEJQLUSDOT-UHFFFAOYSA-N
MW203.21 g/mol
LogP0.76
Rot. Bonds2

About N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide

N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide (PubChem CID 78928131) has the molecular formula C9H9N5O and a molecular weight of 203.21 g/mol. Its IUPAC name is N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
PubChem CID78928131
Molecular FormulaC9H9N5O
Molecular Weight203.21 g/mol
Exact Mass203.08
IUPAC NameN-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide
SMILESCc1nc(NC(=O)c2cccnc2)n[nH]1
InChIInChI=1S/C9H9N5O/c1-6-11-9(14-13-6)12-8(15)7-3-2-4-10-5-7/h2-5H,1H3,(H2,11,12,13,14,15)
InChIKeyXZLDCEJQLUSDOT-UHFFFAOYSA-N
XLogP0.76
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.21
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(1,3,5-triazin-2-yl)pyridine-3-carboxamide
CID 70617129
N-(5-methyl-1H-1,2,4-triazol-3-yl)-3-oxo-3-phenylpropanamide
CID 110473163
N-methylpyridine-3-carboxamide chloride
CID 20976730
N-(4-acetamidophenyl)pyridine-3-carboxamide
CID 766053
N-(4,5-dimethyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 693380
N-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)pyridine-3-carboxamide
CID 4178548
N-(2,6-dimethyl-4-nitrophenyl)pyridine-3-carboxamide
CID 50880463
4-(dimethylsulfamoyl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)benzamide
CID 78928138
3-benzamido-1H-1,2,4-triazole-5-carboxylic acid
CID 4299117
N-[5-(5-methylthiophen-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
CID 51102512
N-[3-(5-methyl-1H-pyrazol-3-yl)phenyl]pyridine-3-carboxamide
CID 110732494
3-hydroxy-4-methoxy-N-(5-methyl-1H-1,2,4-triazol-3-yl)benzamide
CID 79673258

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide?
The IUPAC name of N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide (CID 78928131) is N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide?
The canonical SMILES for N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide is Cc1nc(NC(=O)c2cccnc2)n[nH]1.
What is the InChIKey of N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide?
The InChIKey is XZLDCEJQLUSDOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N5O/c1-6-11-9(14-13-6)12-8(15)7-3-2-4-10-5-7/h2-5H,1H3,(H2,11,12,13,14,15).
What are the key properties of N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide?
N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide has a molecular weight of 203.21 g/mol, XLogP of 0.76, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-1H-1,2,4-triazol-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 78928131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).