6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide

C13H20N4O — CID 79771125

IUPAC6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide
SMILESCC1CCCC(Nc2ccc(C(N)=O)nn2)C1C
InChIInChI=1S/C13H20N4O/c1-8-4-3-5-10(9(8)2)15-12-7-6-11(13(14)18)16-17-12/h6-10H,3-5H2,1-2H3,(H2,14,18)(H,15,17)
InChIKeyJWSVZKTUERTWDO-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.81
Rot. Bonds3

About 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide

6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide (PubChem CID 79771125) has the molecular formula C13H20N4O and a molecular weight of 248.33 g/mol. Its IUPAC name is 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide
PubChem CID79771125
Molecular FormulaC13H20N4O
Molecular Weight248.33 g/mol
Exact Mass248.16
IUPAC Name6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide
SMILESCC1CCCC(Nc2ccc(C(N)=O)nn2)C1C
InChIInChI=1S/C13H20N4O/c1-8-4-3-5-10(9(8)2)15-12-7-6-11(13(14)18)16-17-12/h6-10H,3-5H2,1-2H3,(H2,14,18)(H,15,17)
InChIKeyJWSVZKTUERTWDO-UHFFFAOYSA-N
XLogP1.81
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-[(2-methylcycloheptyl)amino]pyridazine-3-carboxamide
CID 79099687
6-[(2-methylsulfanylcyclohexyl)amino]pyridazine-3-carboxamide
CID 103715276
6-[(2,6-dimethylpiperidin-1-yl)amino]pyridazine-3-carboxamide
CID 83026892
6-[(3-methoxycyclohexyl)amino]pyridazine-3-carboxamide
CID 133399457
methyl 6-[[(1R,2R)-2-aminocyclohexyl]amino]pyridazine-3-carboxylate
CID 93454058
5-[(2,3-dimethylcyclohexyl)amino]-2,4-difluorobenzamide
CID 64761802
6-[[(1S,2S)-2-hydroxycyclohexyl]amino]-N-methylpyridazine-3-carboxamide
CID 133495244
6-[(3-ethyl-2-methylcyclopentyl)amino]pyridazine-3-carboxylic acid
CID 64923554
6-[(1-hydroxy-3-methylcyclohexyl)methylamino]pyridazine-3-carboxamide
CID 79098492
6-[(2,3-dimethylcyclohexyl)amino]-5-nitropyridine-2-carboxylic acid
CID 114403458
4-N-(2,3-dimethylcyclohexyl)-6-hydrazinylpyrimidine-2,4-diamine
CID 80944187
3-[(2,3-dimethylcyclohexyl)amino]pyridazine-4-carbothioamide
CID 80510774

Frequently Asked Questions

What is the IUPAC name of 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide?
The IUPAC name of 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide (CID 79771125) is 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide.
What is the SMILES notation for 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide?
The canonical SMILES for 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide is CC1CCCC(Nc2ccc(C(N)=O)nn2)C1C.
What is the InChIKey of 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide?
The InChIKey is JWSVZKTUERTWDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4O/c1-8-4-3-5-10(9(8)2)15-12-7-6-11(13(14)18)16-17-12/h6-10H,3-5H2,1-2H3,(H2,14,18)(H,15,17).
What are the key properties of 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide?
6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide has a molecular weight of 248.33 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2,3-dimethylcyclohexyl)amino]pyridazine-3-carboxamide is sourced from PubChem (CID 79771125), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).