(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol

C12H10Cl2N2O2 — CID 166178487

IUPAC(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(Cl)cc2Cl)nn1
InChIInChI=1S/C12H10Cl2N2O2/c1-18-11-5-4-10(15-16-11)12(17)8-3-2-7(13)6-9(8)14/h2-6,12,17H,1H3
InChIKeyRYPRIKPYFAIYNW-UHFFFAOYSA-N
MW285.13 g/mol
LogP2.87
Rot. Bonds3

About (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol

(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol (PubChem CID 166178487) has the molecular formula C12H10Cl2N2O2 and a molecular weight of 285.13 g/mol. Its IUPAC name is (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol.

Molecular Properties

Compound Name(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol
PubChem CID166178487
Molecular FormulaC12H10Cl2N2O2
Molecular Weight285.13 g/mol
Exact Mass284.01
IUPAC Name(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(Cl)cc2Cl)nn1
InChIInChI=1S/C12H10Cl2N2O2/c1-18-11-5-4-10(15-16-11)12(17)8-3-2-7(13)6-9(8)14/h2-6,12,17H,1H3
InChIKeyRYPRIKPYFAIYNW-UHFFFAOYSA-N
XLogP2.87
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.13
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2-chlorophenyl)-(6-methoxypyridazin-3-yl)methanol
CID 103373672
(2,4-dichlorophenyl)-(1-methyltriazol-4-yl)methanol
CID 166178328
(6-methoxypyridazin-3-yl)-[2-methyl-4-(trifluoromethyl)phenyl]methanol
CID 103373443
2-(5-chloro-2-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373520
2-(3-chloro-4-fluorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373442
(2,3-dimethylphenyl)-(6-methoxypyridazin-3-yl)methanol
CID 103373534
(2,4-dichlorophenyl)-(2,4-dimethoxyphenyl)methanol
CID 61087695
(3-chloro-4-methoxyphenyl)-(2,4-dichlorophenyl)methanol
CID 61101565
2-(3,4-dichlorophenyl)-1-(6-methoxypyridazin-3-yl)ethanol
CID 103373604
(2,4-dichlorophenyl)-(6-methyl-2-pyridinyl)methanol
CID 114281098
(2,4-dichlorophenyl)-pyrazin-2-ylmethanol
CID 63970677
(2,4-dichlorophenyl)-(3-fluoro-4-methoxyphenyl)methanol
CID 61083249

Frequently Asked Questions

What is the IUPAC name of (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The IUPAC name of (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol (CID 166178487) is (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol.
What is the SMILES notation for (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The canonical SMILES for (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol is COc1ccc(C(O)c2ccc(Cl)cc2Cl)nn1.
What is the InChIKey of (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol?
The InChIKey is RYPRIKPYFAIYNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O2/c1-18-11-5-4-10(15-16-11)12(17)8-3-2-7(13)6-9(8)14/h2-6,12,17H,1H3.
What are the key properties of (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol?
(2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol has a molecular weight of 285.13 g/mol, XLogP of 2.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-dichlorophenyl)-(6-methoxypyridazin-3-yl)methanol is sourced from PubChem (CID 166178487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).