(4-cyclobutylphenyl)-pyridazin-4-ylmethanol

C15H16N2O — CID 105129046

IUPAC(4-cyclobutylphenyl)-pyridazin-4-ylmethanol
SMILESOC(c1ccc(C2CCC2)cc1)c1ccnnc1
InChIInChI=1S/C15H16N2O/c18-15(14-8-9-16-17-10-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-11,15,18H,1-3H2
InChIKeyGSMJFUZANAITKN-UHFFFAOYSA-N
MW240.31 g/mol
LogP2.83
Rot. Bonds3

About (4-cyclobutylphenyl)-pyridazin-4-ylmethanol

(4-cyclobutylphenyl)-pyridazin-4-ylmethanol (PubChem CID 105129046) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is (4-cyclobutylphenyl)-pyridazin-4-ylmethanol.

Molecular Properties

Compound Name(4-cyclobutylphenyl)-pyridazin-4-ylmethanol
PubChem CID105129046
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name(4-cyclobutylphenyl)-pyridazin-4-ylmethanol
SMILESOC(c1ccc(C2CCC2)cc1)c1ccnnc1
InChIInChI=1S/C15H16N2O/c18-15(14-8-9-16-17-10-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-11,15,18H,1-3H2
InChIKeyGSMJFUZANAITKN-UHFFFAOYSA-N
XLogP2.83
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-fluorophenyl)-pyridazin-4-ylmethanol
CID 105077226
(4-cyclohexylphenyl)-(4-iodophenyl)methanol
CID 63427013
(4-cyclobutylphenyl)-(3,4,5-trifluorophenyl)methanol
CID 116505320
(5-bromo-2-pyridinyl)-(4-cyclobutylphenyl)methanol
CID 116505490
(6-methyl-3-pyridinyl)-pyridazin-4-ylmethanol
CID 105096831
(4-chloro-3-methylphenyl)-(4-cyclobutylphenyl)methanol
CID 115836307
(4-bromo-3-chlorophenyl)-(4-cyclobutylphenyl)methanol
CID 115836272
(4-cyclobutylphenyl)-thiophen-2-ylmethanol
CID 116505278
(5-amino-1-methylpyrazol-4-yl)-(4-cyclobutylphenyl)methanol
CID 116505787
1-(4-cyclobutylphenyl)-2-phenylethane-1,2-diol
CID 103459446
(3-chloro-5-fluorophenyl)-(4-cyclobutylphenyl)methanol
CID 114454040
(3-bromo-5-chlorophenyl)-(4-cyclobutylphenyl)methanol
CID 107947823

Frequently Asked Questions

What is the IUPAC name of (4-cyclobutylphenyl)-pyridazin-4-ylmethanol?
The IUPAC name of (4-cyclobutylphenyl)-pyridazin-4-ylmethanol (CID 105129046) is (4-cyclobutylphenyl)-pyridazin-4-ylmethanol.
What is the SMILES notation for (4-cyclobutylphenyl)-pyridazin-4-ylmethanol?
The canonical SMILES for (4-cyclobutylphenyl)-pyridazin-4-ylmethanol is OC(c1ccc(C2CCC2)cc1)c1ccnnc1.
What is the InChIKey of (4-cyclobutylphenyl)-pyridazin-4-ylmethanol?
The InChIKey is GSMJFUZANAITKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c18-15(14-8-9-16-17-10-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-11,15,18H,1-3H2.
What are the key properties of (4-cyclobutylphenyl)-pyridazin-4-ylmethanol?
(4-cyclobutylphenyl)-pyridazin-4-ylmethanol has a molecular weight of 240.31 g/mol, XLogP of 2.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-cyclobutylphenyl)-pyridazin-4-ylmethanol is sourced from PubChem (CID 105129046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).