6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine

C15H17N7 — CID 145270329

IUPAC6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine
SMILESNNc1nc(N)cc(Cc2ccc(-n3cccn3)cc2)c1N
InChIInChI=1S/C15H17N7/c16-13-9-11(14(17)15(20-13)21-18)8-10-2-4-12(5-3-10)22-7-1-6-19-22/h1-7,9H,8,17-18H2,(H3,16,20,21)
InChIKeyVMUOPYCETNFITQ-UHFFFAOYSA-N
MW295.35 g/mol
LogP1.31
Rot. Bonds4

About 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine

6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine (PubChem CID 145270329) has the molecular formula C15H17N7 and a molecular weight of 295.35 g/mol. Its IUPAC name is 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine.

Molecular Properties

Compound Name6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine
PubChem CID145270329
Molecular FormulaC15H17N7
Molecular Weight295.35 g/mol
Exact Mass295.15
IUPAC Name6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine
SMILESNNc1nc(N)cc(Cc2ccc(-n3cccn3)cc2)c1N
InChIInChI=1S/C15H17N7/c16-13-9-11(14(17)15(20-13)21-18)8-10-2-4-12(5-3-10)22-7-1-6-19-22/h1-7,9H,8,17-18H2,(H3,16,20,21)
InChIKeyVMUOPYCETNFITQ-UHFFFAOYSA-N
XLogP1.31
TPSA120.80 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.35
LogP ≤ 51.31
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine?
The IUPAC name of 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine (CID 145270329) is 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine.
What is the SMILES notation for 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine?
The canonical SMILES for 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine is NNc1nc(N)cc(Cc2ccc(-n3cccn3)cc2)c1N.
What is the InChIKey of 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine?
The InChIKey is VMUOPYCETNFITQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N7/c16-13-9-11(14(17)15(20-13)21-18)8-10-2-4-12(5-3-10)22-7-1-6-19-22/h1-7,9H,8,17-18H2,(H3,16,20,21).
What are the key properties of 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine?
6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine has a molecular weight of 295.35 g/mol, XLogP of 1.31, 4 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-4-[(4-pyrazol-1-ylphenyl)methyl]pyridine-2,5-diamine is sourced from PubChem (CID 145270329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).