6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide

C11H10N8O — CID 60982812

IUPAC6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1ncn[nH]1)c1ccc(-n2cncn2)nc1
InChIInChI=1S/C11H10N8O/c20-11(14-4-9-15-6-16-18-9)8-1-2-10(13-3-8)19-7-12-5-17-19/h1-3,5-7H,4H2,(H,14,20)(H,15,16,18)
InChIKeyPXECQHAMFHHMNX-UHFFFAOYSA-N
MW270.26 g/mol
LogP-0.29
Rot. Bonds4

About 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide

6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide (PubChem CID 60982812) has the molecular formula C11H10N8O and a molecular weight of 270.26 g/mol. Its IUPAC name is 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
PubChem CID60982812
Molecular FormulaC11H10N8O
Molecular Weight270.26 g/mol
Exact Mass270.10
IUPAC Name6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
SMILESO=C(NCc1ncn[nH]1)c1ccc(-n2cncn2)nc1
InChIInChI=1S/C11H10N8O/c20-11(14-4-9-15-6-16-18-9)8-1-2-10(13-3-8)19-7-12-5-17-19/h1-3,5-7H,4H2,(H,14,20)(H,15,16,18)
InChIKeyPXECQHAMFHHMNX-UHFFFAOYSA-N
XLogP-0.29
TPSA114.27 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.26
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Analyze 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide with MolForge

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Related Compounds

6-(1,2,4-triazol-1-yl)-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-3-carboxamide
CID 103725935
N-(1H-pyrrol-3-ylmethyl)-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 106385679
N-(2-hydroxyethyl)-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 43416525
6-chloro-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
CID 60983185
N-[2-(ethylamino)ethyl]-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 119507752
6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
CID 64525579
N-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 107847089
N-(1H-pyrazol-4-yl)-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 43429763
N-cyano-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 79194159
4-carbamothioyl-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide
CID 64530382
N-[(1-benzyl-3-phenylpyrazol-4-yl)methyl]-6-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 112813528
1-tert-butyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyrazole-4-carboxamide
CID 132968619

Frequently Asked Questions

What is the IUPAC name of 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide (CID 60982812) is 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide is O=C(NCc1ncn[nH]1)c1ccc(-n2cncn2)nc1.
What is the InChIKey of 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The InChIKey is PXECQHAMFHHMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N8O/c20-11(14-4-9-15-6-16-18-9)8-1-2-10(13-3-8)19-7-12-5-17-19/h1-3,5-7H,4H2,(H,14,20)(H,15,16,18).
What are the key properties of 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide has a molecular weight of 270.26 g/mol, XLogP of -0.29, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 60982812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).