[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol

C13H11Cl2NO — CID 118841793

IUPAC[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol
SMILESCc1cnc(-c2cc(Cl)ccc2Cl)cc1CO
InChIInChI=1S/C13H11Cl2NO/c1-8-6-16-13(4-9(8)7-17)11-5-10(14)2-3-12(11)15/h2-6,17H,7H2,1H3
InChIKeyOEMMTWWSWXNHIZ-UHFFFAOYSA-N
MW268.14 g/mol
LogP3.86
Rot. Bonds2

About [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol

[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol (PubChem CID 118841793) has the molecular formula C13H11Cl2NO and a molecular weight of 268.14 g/mol. Its IUPAC name is [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol
PubChem CID118841793
Molecular FormulaC13H11Cl2NO
Molecular Weight268.14 g/mol
Exact Mass267.02
IUPAC Name[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol
SMILESCc1cnc(-c2cc(Cl)ccc2Cl)cc1CO
InChIInChI=1S/C13H11Cl2NO/c1-8-6-16-13(4-9(8)7-17)11-5-10(14)2-3-12(11)15/h2-6,17H,7H2,1H3
InChIKeyOEMMTWWSWXNHIZ-UHFFFAOYSA-N
XLogP3.86
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.14
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol?
The IUPAC name of [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol (CID 118841793) is [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol.
What is the SMILES notation for [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol?
The canonical SMILES for [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol is Cc1cnc(-c2cc(Cl)ccc2Cl)cc1CO.
What is the InChIKey of [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol?
The InChIKey is OEMMTWWSWXNHIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11Cl2NO/c1-8-6-16-13(4-9(8)7-17)11-5-10(14)2-3-12(11)15/h2-6,17H,7H2,1H3.
What are the key properties of [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol?
[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol has a molecular weight of 268.14 g/mol, XLogP of 3.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol is sourced from PubChem (CID 118841793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).