6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane

C23H34N2O2 — CID 143897176

IUPAC6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane
SMILESCC1CCC1.CCCc1ccc(-c2ccc(=O)n(CCO)n2)cc1CCC
InChIInChI=1S/C18H24N2O2.C5H10/c1-3-5-14-7-8-16(13-15(14)6-4-2)17-9-10-18(22)20(19-17)11-12-21;1-5-3-2-4-5/h7-10,13,21H,3-6,11-12H2,1-2H3;5H,2-4H2,1H3
InChIKeyUCILKYCIWXJWOB-UHFFFAOYSA-N
MW370.54 g/mol
LogP4.61
Rot. Bonds7

About 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane

6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane (PubChem CID 143897176) has the molecular formula C23H34N2O2 and a molecular weight of 370.54 g/mol. Its IUPAC name is 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane.

Molecular Properties

Compound Name6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane
PubChem CID143897176
Molecular FormulaC23H34N2O2
Molecular Weight370.54 g/mol
Exact Mass370.26
IUPAC Name6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane
SMILESCC1CCC1.CCCc1ccc(-c2ccc(=O)n(CCO)n2)cc1CCC
InChIInChI=1S/C18H24N2O2.C5H10/c1-3-5-14-7-8-16(13-15(14)6-4-2)17-9-10-18(22)20(19-17)11-12-21;1-5-3-2-4-5/h7-10,13,21H,3-6,11-12H2,1-2H3;5H,2-4H2,1H3
InChIKeyUCILKYCIWXJWOB-UHFFFAOYSA-N
XLogP4.61
TPSA55.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.54
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)-2-(2-hydroxyethyl)pyridazin-3-one
CID 44540903
6-(3-hydroxy-4-methylphenyl)-2-propylpyridazin-3-one
CID 82105402
5-(3,4-dipropylphenoxy)-2-methylpyridazin-3-one;methylcyclobutane
CID 143897180
N-(2,3-dimethylcyclohexyl)-3-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]propanamide
CID 4136100
N-[1-(2-hydroxyethyl)-3-(4-propylphenyl)pyrazol-5-yl]-2-methylpropanamide
CID 110928398
6-(1,3-benzodioxol-5-yl)-2-[2-(diethylamino)ethyl]pyridazin-3-one
CID 7664039
2-chloro-N-[(1-hydroxycycloheptyl)methyl]-5-[1-(2-hydroxyethyl)-6-oxopyridazin-3-yl]benzamide
CID 18438675
N-(2-methylcyclohexyl)-4-[3-(4-methylphenyl)-6-oxopyridazin-1-yl]butanamide
CID 16885648
2-[2-[(2S,6R)-2,6-dimethylpiperidin-1-yl]-2-oxoethyl]-6-(4-fluorophenyl)pyridazin-3-one
CID 95284309
(6S)-6-(4-fluorophenyl)-N-[5-[1-(2-hydroxyethyl)-6-oxopyridazin-3-yl]-2-methylphenyl]-3-methyl-2-oxo-1,6-dihydropyrimidine-5-carboxamide
CID 70794831
6-(3-amino-4-pyrrolidin-1-ylphenyl)-2-ethylpyridazin-3-one
CID 82105386
2-ethyl-6-(4-fluoro-3-hydroxyphenyl)pyridazin-3-one
CID 82105419

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane?
The IUPAC name of 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane (CID 143897176) is 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane.
What is the SMILES notation for 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane?
The canonical SMILES for 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane is CC1CCC1.CCCc1ccc(-c2ccc(=O)n(CCO)n2)cc1CCC.
What is the InChIKey of 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane?
The InChIKey is UCILKYCIWXJWOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2.C5H10/c1-3-5-14-7-8-16(13-15(14)6-4-2)17-9-10-18(22)20(19-17)11-12-21;1-5-3-2-4-5/h7-10,13,21H,3-6,11-12H2,1-2H3;5H,2-4H2,1H3.
What are the key properties of 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane?
6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane has a molecular weight of 370.54 g/mol, XLogP of 4.61, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dipropylphenyl)-2-(2-hydroxyethyl)pyridazin-3-one;methylcyclobutane is sourced from PubChem (CID 143897176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).