6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide

C12H18N4O — CID 114109607

IUPAC6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NCC2(C)CCC2)nn1
InChIInChI=1S/C12H18N4O/c1-12(6-3-7-12)8-14-11(17)9-4-5-10(13-2)16-15-9/h4-5H,3,6-8H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyXPIVCULFXISEIQ-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.44
Rot. Bonds4

About 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide

6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide (PubChem CID 114109607) has the molecular formula C12H18N4O and a molecular weight of 234.30 g/mol. Its IUPAC name is 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide
PubChem CID114109607
Molecular FormulaC12H18N4O
Molecular Weight234.30 g/mol
Exact Mass234.15
IUPAC Name6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide
SMILESCNc1ccc(C(=O)NCC2(C)CCC2)nn1
InChIInChI=1S/C12H18N4O/c1-12(6-3-7-12)8-14-11(17)9-4-5-10(13-2)16-15-9/h4-5H,3,6-8H2,1-2H3,(H,13,16)(H,14,17)
InChIKeyXPIVCULFXISEIQ-UHFFFAOYSA-N
XLogP1.44
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[4-(3,3,3-TRIFLUORO-2-METHYL-2-TRIFLUOROMETHYLPROPIONYL)PIPERAZIN-1-YL]PYRIDAZINE-3-CARBOXYLIC Acid (2-CYCLOPROPYLETHYL)AMIDE
CID 11442719
N-cyclohexyl-6-(cyclopentylamino)-4-propan-2-ylpyridazine-3-carboxamide
CID 141463764
6-[Cyclobutyl(methyl)amino]pyridazine-3-carboxamide
CID 75377045
6-(butylamino)-N-cyclohexyl-4-propan-2-ylpyridazine-3-carboxamide
CID 141463775
6-[(4,4-Dimethylcyclohexyl)amino]pyridazine-3-carboxamide
CID 79099275
6-amino-N-methylpyridazine-3-carboxamide
CID 62156564
N-(2-cyclopropylethyl)-6-[4-[(Z)-4,4,4-trifluorobut-2-enoyl]piperazin-1-yl]pyridazine-3-carboxamide
CID 71521268
6-(pyrrolidin-1-yl)-N-(2,2,2-trifluoroethyl)pyridazine-3-carboxamide
CID 71778507
6-[cyclobutyl(methyl)amino]-N-methylpyridazine-3-carboxamide
CID 75375755
6-amino-N,N-dimethylpyridazine-3-carboxamide
CID 62154837
N-methyl-6-(piperazin-1-yl)pyridazine-3-carboxamide dihydrochloride
CID 165943092
6-[4-(2-Methylpropyl)piperazin-1-yl]pyridazine-3-carboxamide
CID 71970531

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide (CID 114109607) is 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide is CNc1ccc(C(=O)NCC2(C)CCC2)nn1.
What is the InChIKey of 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide?
The InChIKey is XPIVCULFXISEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O/c1-12(6-3-7-12)8-14-11(17)9-4-5-10(13-2)16-15-9/h4-5H,3,6-8H2,1-2H3,(H,13,16)(H,14,17).
What are the key properties of 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide?
6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-[(1-methylcyclobutyl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 114109607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).