N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide

C11H14N6O — CID 81255598

IUPACN-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide
SMILESCCn1cc(NC(=O)c2cnccc2NN)cn1
InChIInChI=1S/C11H14N6O/c1-2-17-7-8(5-14-17)15-11(18)9-6-13-4-3-10(9)16-12/h3-7H,2,12H2,1H3,(H,13,16)(H,15,18)
InChIKeySWZILIYVYSFMMO-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.84
Rot. Bonds4

About N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide

N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide (PubChem CID 81255598) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide
PubChem CID81255598
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC NameN-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide
SMILESCCn1cc(NC(=O)c2cnccc2NN)cn1
InChIInChI=1S/C11H14N6O/c1-2-17-7-8(5-14-17)15-11(18)9-6-13-4-3-10(9)16-12/h3-7H,2,12H2,1H3,(H,13,16)(H,15,18)
InChIKeySWZILIYVYSFMMO-UHFFFAOYSA-N
XLogP0.84
TPSA97.86 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.84
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 N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide?
The IUPAC name of N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide (CID 81255598) is N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide?
The canonical SMILES for N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide is CCn1cc(NC(=O)c2cnccc2NN)cn1.
What is the InChIKey of N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide?
The InChIKey is SWZILIYVYSFMMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c1-2-17-7-8(5-14-17)15-11(18)9-6-13-4-3-10(9)16-12/h3-7H,2,12H2,1H3,(H,13,16)(H,15,18).
What are the key properties of N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide?
N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.84, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-4-yl)-4-hydrazinylpyridine-3-carboxamide is sourced from PubChem (CID 81255598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).