(2,3-dichlorophenyl)-pyridin-2-ylmethanol

C12H9Cl2NO — CID 62791139

IUPAC(2,3-dichlorophenyl)-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO/c13-9-5-3-4-8(11(9)14)12(16)10-6-1-2-7-15-10/h1-7,12,16H
InChIKeyNPUDLHBDIMHWJQ-UHFFFAOYSA-N
MW254.12 g/mol
LogP3.47
Rot. Bonds2

About (2,3-dichlorophenyl)-pyridin-2-ylmethanol

(2,3-dichlorophenyl)-pyridin-2-ylmethanol (PubChem CID 62791139) has the molecular formula C12H9Cl2NO and a molecular weight of 254.12 g/mol. Its IUPAC name is (2,3-dichlorophenyl)-pyridin-2-ylmethanol.

Molecular Properties

Compound Name(2,3-dichlorophenyl)-pyridin-2-ylmethanol
PubChem CID62791139
Molecular FormulaC12H9Cl2NO
Molecular Weight254.12 g/mol
Exact Mass253.01
IUPAC Name(2,3-dichlorophenyl)-pyridin-2-ylmethanol
SMILESOC(c1ccccn1)c1cccc(Cl)c1Cl
InChIInChI=1S/C12H9Cl2NO/c13-9-5-3-4-8(11(9)14)12(16)10-6-1-2-7-15-10/h1-7,12,16H
InChIKeyNPUDLHBDIMHWJQ-UHFFFAOYSA-N
XLogP3.47
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.12
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol
CID 66459713
2-[1-bromo-1-(2,3-dichlorophenyl)propan-2-yl]pyridine
CID 66454208
2-[1-chloro-1-(2,3-dichlorophenyl)propan-2-yl]pyridine
CID 66461007
dipyridin-2-ylmethanol;palladium(2+);dichloride
CID 173385206
(R)-(2-methylsulfanylphenyl)-pyridin-2-ylmethanol
CID 97292943
(3-bromo-2-fluorophenyl)-pyridin-2-ylmethanol
CID 86730391
(R)-(3-bromo-2-fluorophenyl)-pyridin-2-ylmethanol
CID 129410436
(R)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292895
(S)-(2-ethylphenyl)-pyridin-2-ylmethanol
CID 97292894
phenanthren-9-yl(pyridin-2-yl)methanol
CID 178201671
(R)-(2-nitrophenyl)-pyridin-2-ylmethanol
CID 98041201
(7-chlorophenanthren-9-yl)-pyridin-2-ylmethanol
CID 146508713

Frequently Asked Questions

What is the IUPAC name of (2,3-dichlorophenyl)-pyridin-2-ylmethanol?
The IUPAC name of (2,3-dichlorophenyl)-pyridin-2-ylmethanol (CID 62791139) is (2,3-dichlorophenyl)-pyridin-2-ylmethanol.
What is the SMILES notation for (2,3-dichlorophenyl)-pyridin-2-ylmethanol?
The canonical SMILES for (2,3-dichlorophenyl)-pyridin-2-ylmethanol is OC(c1ccccn1)c1cccc(Cl)c1Cl.
What is the InChIKey of (2,3-dichlorophenyl)-pyridin-2-ylmethanol?
The InChIKey is NPUDLHBDIMHWJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9Cl2NO/c13-9-5-3-4-8(11(9)14)12(16)10-6-1-2-7-15-10/h1-7,12,16H.
What are the key properties of (2,3-dichlorophenyl)-pyridin-2-ylmethanol?
(2,3-dichlorophenyl)-pyridin-2-ylmethanol has a molecular weight of 254.12 g/mol, XLogP of 3.47, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,3-dichlorophenyl)-pyridin-2-ylmethanol is sourced from PubChem (CID 62791139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).