6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide

C10H12N6O — CID 62186175

IUPAC6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide
SMILESNc1ccc(C(=O)NCCn2cccn2)nn1
InChIInChI=1S/C10H12N6O/c11-9-3-2-8(14-15-9)10(17)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7H2,(H2,11,15)(H,12,17)
InChIKeyBQPQCDWTLSMTJR-UHFFFAOYSA-N
MW232.25 g/mol
LogP-0.31
Rot. Bonds4

About 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide

6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide (PubChem CID 62186175) has the molecular formula C10H12N6O and a molecular weight of 232.25 g/mol. Its IUPAC name is 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide
PubChem CID62186175
Molecular FormulaC10H12N6O
Molecular Weight232.25 g/mol
Exact Mass232.11
IUPAC Name6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide
SMILESNc1ccc(C(=O)NCCn2cccn2)nn1
InChIInChI=1S/C10H12N6O/c11-9-3-2-8(14-15-9)10(17)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7H2,(H2,11,15)(H,12,17)
InChIKeyBQPQCDWTLSMTJR-UHFFFAOYSA-N
XLogP-0.31
TPSA98.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide (CID 62186175) is 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide is Nc1ccc(C(=O)NCCn2cccn2)nn1.
What is the InChIKey of 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide?
The InChIKey is BQPQCDWTLSMTJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N6O/c11-9-3-2-8(14-15-9)10(17)12-5-7-16-6-1-4-13-16/h1-4,6H,5,7H2,(H2,11,15)(H,12,17).
What are the key properties of 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide?
6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide has a molecular weight of 232.25 g/mol, XLogP of -0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(2-pyrazol-1-ylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 62186175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).