6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one

C19H18N4O3 — CID 53081825

IUPAC6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one
SMILESO=C(c1ccco1)N1CCN(c2ccc(=O)n(-c3ccccc3)n2)CC1
InChIInChI=1S/C19H18N4O3/c24-18-9-8-17(20-23(18)15-5-2-1-3-6-15)21-10-12-22(13-11-21)19(25)16-7-4-14-26-16/h1-9,14H,10-13H2
InChIKeyLUIIQENFTGJYMP-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.79
Rot. Bonds3

About 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one

6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one (PubChem CID 53081825) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one.

Molecular Properties

Compound Name6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one
PubChem CID53081825
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one
SMILESO=C(c1ccco1)N1CCN(c2ccc(=O)n(-c3ccccc3)n2)CC1
InChIInChI=1S/C19H18N4O3/c24-18-9-8-17(20-23(18)15-5-2-1-3-6-15)21-10-12-22(13-11-21)19(25)16-7-4-14-26-16/h1-9,14H,10-13H2
InChIKeyLUIIQENFTGJYMP-UHFFFAOYSA-N
XLogP1.79
TPSA71.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[4-(4-methylbenzoyl)piperazin-1-yl]-2-phenylpyridazin-3-one
CID 53081832
6-(4-benzoylpiperazin-1-yl)-2-(4-fluorophenyl)pyridazin-3-one
CID 53081727
[4-[6-(azepan-1-yl)pyridazin-3-yl]piperazin-1-yl]-(furan-2-yl)methanone
CID 7292456
furan-2-yl-(4-pyridin-2-ylpiperazin-1-yl)methanone
CID 759046
furan-2-yl-[4-(2-methylpyrimidin-4-yl)piperazin-1-yl]methanone
CID 171130326
furan-2-yl-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]methanone
CID 16883392
6-[4-(3,4-dimethoxybenzoyl)-1,4-diazepan-1-yl]-2-phenylpyridazin-3-one
CID 53081376
2-(4-methylphenyl)-6-[4-(2-phenylacetyl)-1,4-diazepan-1-yl]pyridazin-3-one
CID 53081466
4-[6-[4-(furan-2-carbonyl)piperazine-1-carbonyl]pyridazin-3-yl]piperazine-1-carbaldehyde
CID 109116815
N-[6-[4-(furan-2-carbonyl)piperazin-1-yl]-3-pyridinyl]-2-phenylacetamide
CID 46157200
[4-(3-chlorophenyl)piperazin-1-yl]-(furan-2-yl)methanone
CID 669410
furan-2-yl-[4-(4-phenylpiperazin-1-yl)piperidin-1-yl]methanone
CID 754221

Frequently Asked Questions

What is the IUPAC name of 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one?
The IUPAC name of 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one (CID 53081825) is 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one.
What is the SMILES notation for 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one?
The canonical SMILES for 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one is O=C(c1ccco1)N1CCN(c2ccc(=O)n(-c3ccccc3)n2)CC1.
What is the InChIKey of 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one?
The InChIKey is LUIIQENFTGJYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c24-18-9-8-17(20-23(18)15-5-2-1-3-6-15)21-10-12-22(13-11-21)19(25)16-7-4-14-26-16/h1-9,14H,10-13H2.
What are the key properties of 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one?
6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one has a molecular weight of 350.38 g/mol, XLogP of 1.79, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(furan-2-carbonyl)piperazin-1-yl]-2-phenylpyridazin-3-one is sourced from PubChem (CID 53081825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).