6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one

C15H21N3O2 — CID 126468177

IUPAC6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one
SMILESCCC(=O)N1CCC(n2nc(C3CC3)ccc2=O)CC1
InChIInChI=1S/C15H21N3O2/c1-2-14(19)17-9-7-12(8-10-17)18-15(20)6-5-13(16-18)11-3-4-11/h5-6,11-12H,2-4,7-10H2,1H3
InChIKeySNQLTQMAKWQAKE-UHFFFAOYSA-N
MW275.35 g/mol
LogP1.69
Rot. Bonds3

About 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one

6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one (PubChem CID 126468177) has the molecular formula C15H21N3O2 and a molecular weight of 275.35 g/mol. Its IUPAC name is 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one.

Molecular Properties

Compound Name6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one
PubChem CID126468177
Molecular FormulaC15H21N3O2
Molecular Weight275.35 g/mol
Exact Mass275.16
IUPAC Name6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one
SMILESCCC(=O)N1CCC(n2nc(C3CC3)ccc2=O)CC1
InChIInChI=1S/C15H21N3O2/c1-2-14(19)17-9-7-12(8-10-17)18-15(20)6-5-13(16-18)11-3-4-11/h5-6,11-12H,2-4,7-10H2,1H3
InChIKeySNQLTQMAKWQAKE-UHFFFAOYSA-N
XLogP1.69
TPSA55.20 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3,5-Dimethylpiperidine-1-carbonyl)-2-propylpyridazin-3-one
CID 42910131
N-cyclohexyl-N-cyclopropyl-6-oxo-1-propylpyridazine-3-carboxamide
CID 71942609
2-{[1-(Cyclopentylmethyl)piperidin-4-yl]methyl}-6-cyclopropyl-2,3-dihydropyridazin-3-one
CID 126854434
6-[(2S,6R)-2,6-dimethylpiperidine-1-carbonyl]-2-ethylpyridazin-3-one
CID 132360437
2-Propyl-6-[3-(trifluoromethyl)piperidine-1-carbonyl]pyridazin-3-one
CID 45799636
2-propyl-6-[(3S)-3-(trifluoromethyl)piperidine-1-carbonyl]pyridazin-3-one
CID 93606941
2-propyl-6-[(3R)-3-(trifluoromethyl)piperidine-1-carbonyl]pyridazin-3-one
CID 93606942
6-cyclopropyl-2-(2-(4,4-difluoropiperidin-1-yl)-2-oxoethyl)pyridazin-3(2H)-one
CID 122246408
6-cyclopropyl-2-(1-(4,4-difluoropiperidin-1-yl)-1-oxopropan-2-yl)pyridazin-3(2H)-one
CID 122279082
6-cyclopropyl-2-(1-oxo-1-(4-(trifluoromethyl)piperidin-1-yl)propan-2-yl)pyridazin-3(2H)-one
CID 122279083
6-Cyclopropyl-2-{[1-(2,2,2-trifluoroethyl)piperidin-4-yl]methyl}-2,3-dihydropyridazin-3-one
CID 126865539
6-cyclopropyl-2-[(2S)-1-oxo-1-[4-(trifluoromethyl)piperidin-1-yl]propan-2-yl]pyridazin-3-one
CID 129566067

Frequently Asked Questions

What is the IUPAC name of 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one?
The IUPAC name of 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one (CID 126468177) is 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one.
What is the SMILES notation for 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one?
The canonical SMILES for 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one is CCC(=O)N1CCC(n2nc(C3CC3)ccc2=O)CC1.
What is the InChIKey of 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one?
The InChIKey is SNQLTQMAKWQAKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O2/c1-2-14(19)17-9-7-12(8-10-17)18-15(20)6-5-13(16-18)11-3-4-11/h5-6,11-12H,2-4,7-10H2,1H3.
What are the key properties of 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one?
6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one has a molecular weight of 275.35 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopropyl-2-(1-propanoylpiperidin-4-yl)pyridazin-3-one is sourced from PubChem (CID 126468177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).