4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide

C12H16N6O — CID 81256862

IUPAC4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)NCCn2cccn2)cn1
InChIInChI=1S/C12H16N6O/c1-9-7-11(17-13)10(8-15-9)12(19)14-4-6-18-5-2-3-16-18/h2-3,5,7-8H,4,6,13H2,1H3,(H,14,19)(H,15,17)
InChIKeyVOOFJUAJWOMXIW-UHFFFAOYSA-N
MW260.30 g/mol
LogP0.30
Rot. Bonds5

About 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide

4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide (PubChem CID 81256862) has the molecular formula C12H16N6O and a molecular weight of 260.30 g/mol. Its IUPAC name is 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide
PubChem CID81256862
Molecular FormulaC12H16N6O
Molecular Weight260.30 g/mol
Exact Mass260.14
IUPAC Name4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide
SMILESCc1cc(NN)c(C(=O)NCCn2cccn2)cn1
InChIInChI=1S/C12H16N6O/c1-9-7-11(17-13)10(8-15-9)12(19)14-4-6-18-5-2-3-16-18/h2-3,5,7-8H,4,6,13H2,1H3,(H,14,19)(H,15,17)
InChIKeyVOOFJUAJWOMXIW-UHFFFAOYSA-N
XLogP0.30
TPSA97.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 50.30
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide (CID 81256862) is 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide is Cc1cc(NN)c(C(=O)NCCn2cccn2)cn1.
What is the InChIKey of 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide?
The InChIKey is VOOFJUAJWOMXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N6O/c1-9-7-11(17-13)10(8-15-9)12(19)14-4-6-18-5-2-3-16-18/h2-3,5,7-8H,4,6,13H2,1H3,(H,14,19)(H,15,17).
What are the key properties of 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide?
4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide has a molecular weight of 260.30 g/mol, XLogP of 0.30, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-6-methyl-N-(2-pyrazol-1-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 81256862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).