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

C9H11N7O — CID 64525579

IUPAC6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
SMILESNNc1ccc(C(=O)NCc2ncn[nH]2)cn1
InChIInChI=1S/C9H11N7O/c10-15-7-2-1-6(3-11-7)9(17)12-4-8-13-5-14-16-8/h1-3,5H,4,10H2,(H,11,15)(H,12,17)(H,13,14,16)
InChIKeyCTDPIEKCDWSRKX-UHFFFAOYSA-N
MW233.24 g/mol
LogP-0.58
Rot. Bonds4

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

6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide (PubChem CID 64525579) has the molecular formula C9H11N7O and a molecular weight of 233.24 g/mol. Its IUPAC name is 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
PubChem CID64525579
Molecular FormulaC9H11N7O
Molecular Weight233.24 g/mol
Exact Mass233.10
IUPAC Name6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
SMILESNNc1ccc(C(=O)NCc2ncn[nH]2)cn1
InChIInChI=1S/C9H11N7O/c10-15-7-2-1-6(3-11-7)9(17)12-4-8-13-5-14-16-8/h1-3,5H,4,10H2,(H,11,15)(H,12,17)(H,13,14,16)
InChIKeyCTDPIEKCDWSRKX-UHFFFAOYSA-N
XLogP-0.58
TPSA121.61 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.24
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-chloro-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
CID 60983185
4-carbamothioyl-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide
CID 64530382
3-chloro-6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-2-carboxamide
CID 64524391
N-ethyl-6-hydrazinylpyridine-3-carboxamide
CID 20734038
5-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-2-carboxamide
CID 104642847
6-(1,2,4-triazol-1-yl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
CID 60982812
6-hydrazinyl-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
CID 51370237
2-(aminomethyl)-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-4-carboxamide
CID 113277765
3,5-dimethyl-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide
CID 54883677
3-bromo-4-fluoro-N-(1H-1,2,4-triazol-5-ylmethyl)benzamide
CID 113244827
2,6-dichloro-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-4-carboxamide
CID 61041672
5-bromo-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide
CID 55021438

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide (CID 64525579) is 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide is NNc1ccc(C(=O)NCc2ncn[nH]2)cn1.
What is the InChIKey of 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
The InChIKey is CTDPIEKCDWSRKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N7O/c10-15-7-2-1-6(3-11-7)9(17)12-4-8-13-5-14-16-8/h1-3,5H,4,10H2,(H,11,15)(H,12,17)(H,13,14,16).
What are the key properties of 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide?
6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide has a molecular weight of 233.24 g/mol, XLogP of -0.58, 4 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(1H-1,2,4-triazol-5-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 64525579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).