[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol

C13H10Cl3NO2 — CID 134636475

IUPAC[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol
SMILESCOc1ccc(-c2c(Cl)cc(Cl)cc2Cl)c(CO)n1
InChIInChI=1S/C13H10Cl3NO2/c1-19-12-3-2-8(11(6-18)17-12)13-9(15)4-7(14)5-10(13)16/h2-5,18H,6H2,1H3
InChIKeyVXJZEYWBERTURY-UHFFFAOYSA-N
MW318.59 g/mol
LogP4.21
Rot. Bonds3

About [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol

[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol (PubChem CID 134636475) has the molecular formula C13H10Cl3NO2 and a molecular weight of 318.59 g/mol. Its IUPAC name is [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol
PubChem CID134636475
Molecular FormulaC13H10Cl3NO2
Molecular Weight318.59 g/mol
Exact Mass316.98
IUPAC Name[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol
SMILESCOc1ccc(-c2c(Cl)cc(Cl)cc2Cl)c(CO)n1
InChIInChI=1S/C13H10Cl3NO2/c1-19-12-3-2-8(11(6-18)17-12)13-9(15)4-7(14)5-10(13)16/h2-5,18H,6H2,1H3
InChIKeyVXJZEYWBERTURY-UHFFFAOYSA-N
XLogP4.21
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.59
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-chloro-6-methoxy-2-pyridinyl)methanol
CID 51341990
3-chloro-2-ethyl-6-methoxypyridine
CID 123175687
[5,6-bis(2,4,6-trichlorophenyl)-2-pyridinyl]methanol
CID 134617493
[3,6-bis(2,3,5-trichlorophenyl)-2-pyridinyl]methanol
CID 134637996
[3-chloro-6-(3,5-dimethoxyphenoxy)-2-pyridinyl]methanol
CID 61257718
[3,6-bis(2,3,4,5,6-pentachlorophenyl)-2-pyridinyl]methanol
CID 134623898
(3-chloro-6-methoxy-2-pyridinyl)methanamine;hydrochloride
CID 171363984
2-[6-methoxy-5-(2,4,6-trichlorophenyl)-2-pyridinyl]acetic acid
CID 134636431
1,3,5-trichloro-2-(2-chloro-4-methoxyphenyl)benzene
CID 134628384
methyl 3-[3-[2-(hydroxymethyl)-6-methoxy-3-pyridinyl]-4-methoxyphenyl]propanoate
CID 165341079
4-(2,4-dichlorophenyl)-6-methoxypyrimidin-2-amine
CID 39826310
methyl 6-chloro-5-(2,4,6-trichlorophenyl)pyridine-2-carboxylate
CID 134636636

Frequently Asked Questions

What is the IUPAC name of [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol?
The IUPAC name of [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol (CID 134636475) is [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol.
What is the SMILES notation for [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol?
The canonical SMILES for [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol is COc1ccc(-c2c(Cl)cc(Cl)cc2Cl)c(CO)n1.
What is the InChIKey of [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol?
The InChIKey is VXJZEYWBERTURY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10Cl3NO2/c1-19-12-3-2-8(11(6-18)17-12)13-9(15)4-7(14)5-10(13)16/h2-5,18H,6H2,1H3.
What are the key properties of [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol?
[6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol has a molecular weight of 318.59 g/mol, XLogP of 4.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methoxy-3-(2,4,6-trichlorophenyl)-2-pyridinyl]methanol is sourced from PubChem (CID 134636475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).