[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol

C12H8Cl3NO — CID 119006954

IUPAC[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol
SMILESOCc1cc(Cl)nc(-c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C12H8Cl3NO/c13-8-1-2-10(14)9(5-8)11-3-7(6-17)4-12(15)16-11/h1-5,17H,6H2
InChIKeyUIFCASMUGPCMIY-UHFFFAOYSA-N
MW288.56 g/mol
LogP4.20
Rot. Bonds2

About [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol

[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol (PubChem CID 119006954) has the molecular formula C12H8Cl3NO and a molecular weight of 288.56 g/mol. Its IUPAC name is [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol.

Molecular Properties

Compound Name[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol
PubChem CID119006954
Molecular FormulaC12H8Cl3NO
Molecular Weight288.56 g/mol
Exact Mass286.97
IUPAC Name[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol
SMILESOCc1cc(Cl)nc(-c2cc(Cl)ccc2Cl)c1
InChIInChI=1S/C12H8Cl3NO/c13-8-1-2-10(14)9(5-8)11-3-7(6-17)4-12(15)16-11/h1-5,17H,6H2
InChIKeyUIFCASMUGPCMIY-UHFFFAOYSA-N
XLogP4.20
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.56
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

[2-chloro-6-(3-chloro-4-fluorophenyl)-4-pyridinyl]methanol
CID 90062081
2-chloro-6-(2,5-dichlorophenyl)pyridine-4-carbaldehyde
CID 119017180
[6-(2,5-dichlorophenyl)-2-methyl-3-pyridinyl]methanol
CID 82452812
2-tert-butyl-4-chloro-6-(2,5-dichlorophenyl)pyrimidine
CID 80953036
[6-amino-5-(2,5-dichlorophenyl)-3-pyridinyl]methanol
CID 118997102
[2-(2,5-dichlorophenyl)-5-methyl-4-pyridinyl]methanol
CID 118841793
2-chloro-6-(2,4-dichlorophenyl)pyridine-4-carbaldehyde
CID 91871877
2-[3-chloro-6-(2,5-dichlorophenyl)-2-pyridinyl]acetic acid
CID 133088320
3-[[4-(2,5-dichlorophenyl)-1,3-thiazol-2-yl]methylamino]propan-1-ol
CID 109379738
2-(2,5-dichlorophenyl)-6-methylpyridine-4-carboxylic acid
CID 118841905
2,6-dichloro-3-(2,5-dichlorophenyl)pyridine
CID 118999400
[2-(3,6-dichloro-2-pyridinyl)-4-pyridinyl]methanol
CID 87929835

Frequently Asked Questions

What is the IUPAC name of [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol?
The IUPAC name of [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol (CID 119006954) is [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol.
What is the SMILES notation for [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol?
The canonical SMILES for [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol is OCc1cc(Cl)nc(-c2cc(Cl)ccc2Cl)c1.
What is the InChIKey of [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol?
The InChIKey is UIFCASMUGPCMIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Cl3NO/c13-8-1-2-10(14)9(5-8)11-3-7(6-17)4-12(15)16-11/h1-5,17H,6H2.
What are the key properties of [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol?
[2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol has a molecular weight of 288.56 g/mol, XLogP of 4.20, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-chloro-6-(2,5-dichlorophenyl)-4-pyridinyl]methanol is sourced from PubChem (CID 119006954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).