3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one

C12H18N4O2 — CID 110483200

IUPAC3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one
SMILESCN(C)C1CCN(C(=O)c2ccc(=O)[nH]n2)CC1
InChIInChI=1S/C12H18N4O2/c1-15(2)9-5-7-16(8-6-9)12(18)10-3-4-11(17)14-13-10/h3-4,9H,5-8H2,1-2H3,(H,14,17)
InChIKeyHYESXMNPSOECRE-UHFFFAOYSA-N
MW250.30 g/mol
LogP-0.06
Rot. Bonds2

About 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one

3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one (PubChem CID 110483200) has the molecular formula C12H18N4O2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one.

Molecular Properties

Compound Name3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one
PubChem CID110483200
Molecular FormulaC12H18N4O2
Molecular Weight250.30 g/mol
Exact Mass250.14
IUPAC Name3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one
SMILESCN(C)C1CCN(C(=O)c2ccc(=O)[nH]n2)CC1
InChIInChI=1S/C12H18N4O2/c1-15(2)9-5-7-16(8-6-9)12(18)10-3-4-11(17)14-13-10/h3-4,9H,5-8H2,1-2H3,(H,14,17)
InChIKeyHYESXMNPSOECRE-UHFFFAOYSA-N
XLogP-0.06
TPSA69.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 5-0.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one 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

3-(4-propylpiperidine-1-carbonyl)-1H-pyridazin-6-one
CID 103720325
3-(4-amino-3,3-dimethylpiperidine-1-carbonyl)-1H-pyridazin-6-one
CID 114267658
2-[1-(6-oxo-1H-pyridazine-3-carbonyl)piperidin-4-yl]acetic acid
CID 78980909
3-(3,5-dimethylpiperidine-1-carbonyl)-1H-pyridazin-6-one
CID 5227998
3-[4-(cyclopentanecarbonyl)piperazine-1-carbonyl]-1H-pyridazin-6-one
CID 38390180
3-(3,4-dimethylpyrrolidine-1-carbonyl)-1H-pyridazin-6-one
CID 103709631
[4-(dimethylamino)piperidin-1-yl]-(5-ethyl-1H-pyrazol-3-yl)methanone
CID 78873940
3-[4-(morpholine-4-carbonyl)piperidine-1-carbonyl]-1H-pyridazin-6-one
CID 38489921
3-[4-(pyridine-4-carbonyl)piperazine-1-carbonyl]-1H-pyridazin-6-one
CID 110803019
4-(6-oxo-1H-pyridazine-3-carbonyl)-N-propan-2-ylpiperazine-1-carboxamide
CID 110812163
3-[4-(2-cyclopentylacetyl)piperazine-1-carbonyl]-1H-pyridazin-6-one
CID 30831093
3-[4-(2-phenylethyl)piperidine-1-carbonyl]-1H-pyridazin-6-one
CID 35951602

Frequently Asked Questions

What is the IUPAC name of 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one?
The IUPAC name of 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one (CID 110483200) is 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one.
What is the SMILES notation for 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one?
The canonical SMILES for 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one is CN(C)C1CCN(C(=O)c2ccc(=O)[nH]n2)CC1.
What is the InChIKey of 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one?
The InChIKey is HYESXMNPSOECRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4O2/c1-15(2)9-5-7-16(8-6-9)12(18)10-3-4-11(17)14-13-10/h3-4,9H,5-8H2,1-2H3,(H,14,17).
What are the key properties of 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one?
3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one has a molecular weight of 250.30 g/mol, XLogP of -0.06, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(dimethylamino)piperidine-1-carbonyl]-1H-pyridazin-6-one is sourced from PubChem (CID 110483200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).