(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol

C14H16N2O2 — CID 103373534

IUPAC(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2cccc(C)c2C)nn1
InChIInChI=1S/C14H16N2O2/c1-9-5-4-6-11(10(9)2)14(17)12-7-8-13(18-3)16-15-12/h4-8,14,17H,1-3H3
InChIKeySZGQNLCANRGTLG-UHFFFAOYSA-N
MW244.29 g/mol
LogP2.18
Rot. Bonds3

About (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol

(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol (PubChem CID 103373534) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol.

Molecular Properties

Compound Name(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol
PubChem CID103373534
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2cccc(C)c2C)nn1
InChIInChI=1S/C14H16N2O2/c1-9-5-4-6-11(10(9)2)14(17)12-7-8-13(18-3)16-15-12/h4-8,14,17H,1-3H3
InChIKeySZGQNLCANRGTLG-UHFFFAOYSA-N
XLogP2.18
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chlorophenyl)-(6-methoxypyridazin-3-yl)methanol
CID 103373672
(6-methoxypyridazin-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 103373443
(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol
CID 166178487
(2,3-dimethylphenyl)-(2-fluoro-3-methoxyphenyl)methanol
CID 82806744
(2,3-dimethylphenyl)-pyrimidin-4-ylmethanol
CID 63988087
(4-chloro-2-methoxyphenyl)-(2,3-dimethylphenyl)methanol
CID 115791592
(6-methoxypyridazin-3-yl)-pyrimidin-5-ylmethanol
CID 103373686
(2,3-dimethylphenyl)-(1-methylimidazol-4-yl)methanol
CID 107978292
(2-bromo-4,5-dimethoxyphenyl)-(2,3-dimethylphenyl)methanol
CID 61087207
(2,6-difluoro-4-methoxyphenyl)-(2,3-dimethylphenyl)methanol
CID 61099270
2,3-dihydrofuran-5-yl-(6-methoxypyridazin-3-yl)methanol
CID 103373421
(4-bromo-2-methoxyphenyl)-(2,3-dimethylphenyl)methanol
CID 115791553

Frequently Asked Questions

What is the IUPAC name of (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The IUPAC name of (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol (CID 103373534) is (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol.
What is the SMILES notation for (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The canonical SMILES for (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol is COc1ccc(C(O)c2cccc(C)c2C)nn1.
What is the InChIKey of (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol?
The InChIKey is SZGQNLCANRGTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-9-5-4-6-11(10(9)2)14(17)12-7-8-13(18-3)16-15-12/h4-8,14,17H,1-3H3.
What are the key properties of (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol?
(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol has a molecular weight of 244.29 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol is sourced from PubChem (CID 103373534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).