3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide

C6H8N4O2 — CID 137400064

IUPAC3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide
SMILESCNc1n[nH]c(=O)cc1C(N)=O
InChIInChI=1S/C6H8N4O2/c1-8-6-3(5(7)12)2-4(11)9-10-6/h2H,1H3,(H2,7,12)(H,8,10)(H,9,11)
InChIKeyFGVKVQZZAXRAEP-UHFFFAOYSA-N
MW168.16 g/mol
LogP-1.09
Rot. Bonds2

About 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide

3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide (PubChem CID 137400064) has the molecular formula C6H8N4O2 and a molecular weight of 168.16 g/mol. Its IUPAC name is 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide.

Molecular Properties

Compound Name3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide
PubChem CID137400064
Molecular FormulaC6H8N4O2
Molecular Weight168.16 g/mol
Exact Mass168.06
IUPAC Name3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide
SMILESCNc1n[nH]c(=O)cc1C(N)=O
InChIInChI=1S/C6H8N4O2/c1-8-6-3(5(7)12)2-4(11)9-10-6/h2H,1H3,(H2,7,12)(H,8,10)(H,9,11)
InChIKeyFGVKVQZZAXRAEP-UHFFFAOYSA-N
XLogP-1.09
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 5-1.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide?
The IUPAC name of 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide (CID 137400064) is 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide.
What is the SMILES notation for 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide?
The canonical SMILES for 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide is CNc1n[nH]c(=O)cc1C(N)=O.
What is the InChIKey of 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide?
The InChIKey is FGVKVQZZAXRAEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O2/c1-8-6-3(5(7)12)2-4(11)9-10-6/h2H,1H3,(H2,7,12)(H,8,10)(H,9,11).
What are the key properties of 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide?
3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide has a molecular weight of 168.16 g/mol, XLogP of -1.09, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methylamino)-6-oxo-1H-pyridazine-4-carboxamide is sourced from PubChem (CID 137400064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).