(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol

C15H13N3O — CID 105118439

IUPAC(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol
SMILESCc1ccc2cc(C(O)c3ccnnc3)ccc2n1
InChIInChI=1S/C15H13N3O/c1-10-2-3-11-8-12(4-5-14(11)18-10)15(19)13-6-7-16-17-9-13/h2-9,15,19H,1H3
InChIKeyNHFBAWTZRAZYAM-UHFFFAOYSA-N
MW251.29 g/mol
LogP2.41
Rot. Bonds2

About (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol

(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol (PubChem CID 105118439) has the molecular formula C15H13N3O and a molecular weight of 251.29 g/mol. Its IUPAC name is (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol.

Molecular Properties

Compound Name(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol
PubChem CID105118439
Molecular FormulaC15H13N3O
Molecular Weight251.29 g/mol
Exact Mass251.11
IUPAC Name(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol
SMILESCc1ccc2cc(C(O)c3ccnnc3)ccc2n1
InChIInChI=1S/C15H13N3O/c1-10-2-3-11-8-12(4-5-14(11)18-10)15(19)13-6-7-16-17-9-13/h2-9,15,19H,1H3
InChIKeyNHFBAWTZRAZYAM-UHFFFAOYSA-N
XLogP2.41
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-1-(2-methylquinolin-6-yl)-1-pyridazin-4-ylmethanamine
CID 105172295
(6-methyl-3-pyridinyl)-pyridazin-4-ylmethanol
CID 105096831
(4-amino-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105379142
(2-methylquinolin-6-yl)-thiophen-2-ylmethanol
CID 81215895
(1-methylcyclopentyl)-(2-methylquinolin-6-yl)methanol
CID 115826661
(2-amino-1,3-thiazol-5-yl)-(2-methylquinolin-6-yl)methanol
CID 105379207
(1,5-dimethylpyrazol-4-yl)-(2-methylquinolin-6-yl)methanol
CID 81215608
(3-methoxy-4-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105066395
1-(2-methylquinolin-6-yl)propan-1-ol
CID 81216711
(2-methylquinolin-6-yl)-pyridazin-4-ylmethanone
CID 105121470
(2-methylquinolin-6-yl)-(1,3-thiazol-4-yl)methanol
CID 81220837
(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol
CID 115826569

Frequently Asked Questions

What is the IUPAC name of (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol?
The IUPAC name of (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol (CID 105118439) is (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol.
What is the SMILES notation for (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol?
The canonical SMILES for (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol is Cc1ccc2cc(C(O)c3ccnnc3)ccc2n1.
What is the InChIKey of (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol?
The InChIKey is NHFBAWTZRAZYAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-10-2-3-11-8-12(4-5-14(11)18-10)15(19)13-6-7-16-17-9-13/h2-9,15,19H,1H3.
What are the key properties of (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol?
(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol has a molecular weight of 251.29 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylquinolin-6-yl)-pyridazin-4-ylmethanol is sourced from PubChem (CID 105118439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).