(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone

C14H22N4O — CID 109109406

IUPAC(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone
SMILESCC1CCN(C(=O)c2ccc(NC(C)C)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-10(2)15-13-5-4-12(16-17-13)14(19)18-8-6-11(3)7-9-18/h4-5,10-11H,6-9H2,1-3H3,(H,15,17)
InChIKeyFPOMZMAAMUWKST-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.17
Rot. Bonds3

About (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone

(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone (PubChem CID 109109406) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone
PubChem CID109109406
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone
SMILESCC1CCN(C(=O)c2ccc(NC(C)C)nn2)CC1
InChIInChI=1S/C14H22N4O/c1-10(2)15-13-5-4-12(16-17-13)14(19)18-8-6-11(3)7-9-18/h4-5,10-11H,6-9H2,1-3H3,(H,15,17)
InChIKeyFPOMZMAAMUWKST-UHFFFAOYSA-N
XLogP2.17
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone with MolForge

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

Launch Full Analysis

Related Compounds

[6-(butan-2-ylamino)pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109111350
(4-methylpiperidin-1-yl)-[6-(1-phenylethylamino)pyridazin-3-yl]methanone
CID 109113330
4-[6-(propan-2-ylamino)pyridazine-3-carbonyl]piperazine-1-carbaldehyde
CID 109109417
(4-methylpiperidin-1-yl)-(6-propan-2-ylpyridazin-3-yl)methanone
CID 113200329
[6-(2,6-difluoroanilino)pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109113489
(6-hydrazinylpyridazin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 103502396
[6-(butan-2-ylamino)pyridazin-3-yl]-piperidin-1-ylmethanone
CID 109111348
[6-(3-methylanilino)pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109113392
[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109113327
(3-methylpyrrolidin-1-yl)-[6-(propan-2-ylamino)-2-pyridinyl]methanone
CID 115498253
(3-methylpiperidin-1-yl)-[6-(2-methylpropylamino)pyridazin-3-yl]methanone
CID 109111042
[4-(2,3-dimethylphenyl)piperazin-1-yl]-[6-(propan-2-ylamino)pyridazin-3-yl]methanone
CID 109109462

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone (CID 109109406) is (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone is CC1CCN(C(=O)c2ccc(NC(C)C)nn2)CC1.
What is the InChIKey of (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone?
The InChIKey is FPOMZMAAMUWKST-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-10(2)15-13-5-4-12(16-17-13)14(19)18-8-6-11(3)7-9-18/h4-5,10-11H,6-9H2,1-3H3,(H,15,17).
What are the key properties of (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone?
(4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone has a molecular weight of 262.36 g/mol, XLogP of 2.17, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-[6-(propan-2-ylamino)pyridazin-3-yl]methanone is sourced from PubChem (CID 109109406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).