5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide

C11H15N7O — CID 104643052

IUPAC5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCCCn2ccnn2)nc1
InChIInChI=1S/C11H15N7O/c12-16-9-2-3-10(14-8-9)11(19)13-4-1-6-18-7-5-15-17-18/h2-3,5,7-8,16H,1,4,6,12H2,(H,13,19)
InChIKeyKVEJBUJAUWGZST-UHFFFAOYSA-N
MW261.29 g/mol
LogP-0.22
Rot. Bonds6

About 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide

5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide (PubChem CID 104643052) has the molecular formula C11H15N7O and a molecular weight of 261.29 g/mol. Its IUPAC name is 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide
PubChem CID104643052
Molecular FormulaC11H15N7O
Molecular Weight261.29 g/mol
Exact Mass261.13
IUPAC Name5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide
SMILESNNc1ccc(C(=O)NCCCn2ccnn2)nc1
InChIInChI=1S/C11H15N7O/c12-16-9-2-3-10(14-8-9)11(19)13-4-1-6-18-7-5-15-17-18/h2-3,5,7-8,16H,1,4,6,12H2,(H,13,19)
InChIKeyKVEJBUJAUWGZST-UHFFFAOYSA-N
XLogP-0.22
TPSA110.75 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.29
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

5-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-2-carboxamide
CID 104643051
5-hydrazinyl-N-propylpyridine-2-carboxamide
CID 104642261
5-hydrazinyl-N-[2-(2-methylpyrazol-3-yl)ethyl]pyridine-2-carboxamide
CID 103011437
4-(ethylsulfonylamino)-N-[3-(triazol-1-yl)propyl]benzamide
CID 135103024
N-[2-(dimethylcarbamoylamino)ethyl]-5-hydrazinylpyridine-2-carboxamide
CID 113436386
5-hydrazinyl-N-[2-(1-methylpyrazol-4-yl)ethyl]pyridine-2-carboxamide
CID 113436378
3-sulfanyl-N-[3-(triazol-1-yl)propyl]benzamide
CID 107034799
5-hydrazinyl-N-[2-(1-methylpiperidin-4-yl)ethyl]pyridine-2-carboxamide
CID 114516677
5-hydrazinyl-N-(pyridin-4-ylmethyl)pyridine-2-carboxamide
CID 104642246
3-hydrazinyl-N-[2-(triazol-1-yl)ethyl]pyridine-4-carboxamide
CID 105072445
6-oxo-N-[2-(triazol-1-yl)ethyl]-1H-pyridazine-3-carboxamide
CID 113375229
N-(cyclopropylmethyl)-5-hydrazinylpyridine-2-carboxamide
CID 104642346

Frequently Asked Questions

What is the IUPAC name of 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide?
The IUPAC name of 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide (CID 104643052) is 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide?
The canonical SMILES for 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide is NNc1ccc(C(=O)NCCCn2ccnn2)nc1.
What is the InChIKey of 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide?
The InChIKey is KVEJBUJAUWGZST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N7O/c12-16-9-2-3-10(14-8-9)11(19)13-4-1-6-18-7-5-15-17-18/h2-3,5,7-8,16H,1,4,6,12H2,(H,13,19).
What are the key properties of 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide?
5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide has a molecular weight of 261.29 g/mol, XLogP of -0.22, 6 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydrazinyl-N-[3-(triazol-1-yl)propyl]pyridine-2-carboxamide is sourced from PubChem (CID 104643052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).