6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one

C14H16N2O2 — CID 1475382

IUPAC6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one
SMILESCOc1ccc(C=CC2=NN(C)C(=O)CC2)cc1
InChIInChI=1S/C14H16N2O2/c1-16-14(17)10-7-12(15-16)6-3-11-4-8-13(18-2)9-5-11/h3-6,8-9H,7,10H2,1-2H3
InChIKeyWEWIIGRQOVQDCT-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.32
Rot. Bonds3

About 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one

6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one (PubChem CID 1475382) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one.

Molecular Properties

Compound Name6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one
PubChem CID1475382
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one
SMILESCOc1ccc(C=CC2=NN(C)C(=O)CC2)cc1
InChIInChI=1S/C14H16N2O2/c1-16-14(17)10-7-12(15-16)6-3-11-4-8-13(18-2)9-5-11/h3-6,8-9H,7,10H2,1-2H3
InChIKeyWEWIIGRQOVQDCT-UHFFFAOYSA-N
XLogP2.32
TPSA41.90 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-[3-[(E)-2-(4-methoxyphenyl)ethenyl]-6-oxo-4,5-dihydropyridazin-1-yl]benzenesulfonamide
CID 171344027
1-methoxy-4-[2-[4-[2-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]benzene
CID 76573307
1-[(E)-3-(4-methoxyphenyl)prop-2-enoxy]pyrrolidine-2,5-dione
CID 154707822
5-(4-methoxyphenyl)-2-methyl-4H-pyrazol-3-one
CID 15145018
1-methoxy-4-[2-[4-[4-[2-(4-methoxyphenyl)ethenyl]phenyl]phenyl]ethenyl]benzene
CID 54482883
4-[(E)-2-[3-[(E)-2-[3,5-bis[(E)-2-[3,5-bis[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]ethenyl]phenyl]ethenyl]-5-[(E)-2-(4-formylphenyl)ethenyl]phenyl]ethenyl]benzaldehyde
CID 102018921
6-[(E)-2-(4-methylphenyl)ethenyl]-2-prop-2-enyl-4,5-dihydropyridazin-3-one
CID 1475372
(2,5-dioxopyrrolidin-1-yl) (2E,4E)-5-(4-methoxyphenyl)penta-2,4-dienoate
CID 146567329
1,2-dichloro-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzene
CID 122615244
(3S)-3-(4-methoxyphenyl)-5-[(Z)-2-(4-methoxyphenyl)ethenyl]-2-phenyl-3,4-dihydropyrazole
CID 92909932
4-methoxy(1,2,3,4,5,6-13C6)cyclohexa-1,3,5-triene-1-carbaldehyde
CID 46780459
2-amino-5-[2-(4-methoxyphenyl)ethenyl]cyclohepta-2,4,6-trien-1-one
CID 71387303

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one?
The IUPAC name of 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one (CID 1475382) is 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one.
What is the SMILES notation for 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one?
The canonical SMILES for 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one is COc1ccc(C=CC2=NN(C)C(=O)CC2)cc1.
What is the InChIKey of 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one?
The InChIKey is WEWIIGRQOVQDCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-16-14(17)10-7-12(15-16)6-3-11-4-8-13(18-2)9-5-11/h3-6,8-9H,7,10H2,1-2H3.
What are the key properties of 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one?
6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one has a molecular weight of 244.29 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methoxyphenyl)ethenyl]-2-methyl-4,5-dihydropyridazin-3-one is sourced from PubChem (CID 1475382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).