1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol

C14H13Cl2NO — CID 66459713

IUPAC1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol
SMILESCC(c1ccccn1)C(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-9(12-7-2-3-8-17-12)14(18)10-5-4-6-11(15)13(10)16/h2-9,14,18H,1H3
InChIKeyUJPUVZJOOYJAMM-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.23
Rot. Bonds3

About 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol

1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol (PubChem CID 66459713) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol
PubChem CID66459713
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol
SMILESCC(c1ccccn1)C(O)c1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-9(12-7-2-3-8-17-12)14(18)10-5-4-6-11(15)13(10)16/h2-9,14,18H,1H3
InChIKeyUJPUVZJOOYJAMM-UHFFFAOYSA-N
XLogP4.23
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-chloro-1-(2,3-dichlorophenyl)propan-2-yl]pyridine
CID 66461007
2-[1-bromo-1-(2,3-dichlorophenyl)propan-2-yl]pyridine
CID 66454208
(2,3-dichlorophenyl)-pyridin-2-ylmethanol
CID 62791139
1-(2-chloro-4-fluorophenyl)-2-pyridin-2-ylpropan-1-ol
CID 66460513
1-(2-bromo-4-chlorophenyl)-2-pyridin-2-ylpropan-1-ol
CID 107995601
2-[1-bromo-1-(2-chlorophenyl)propan-2-yl]pyridine
CID 66453993
1-(5-chlorofuran-2-yl)-2-pyridin-2-ylpropan-1-ol
CID 106690716
(1R,2R)-1-(2,3-dichlorophenyl)propane-1,2-diol;(1S,2S)-1-(2,3-dichlorophenyl)propane-1,2-diol;methane
CID 158468254
(1S,2S)-1-pyridin-2-ylpropane-1,2-diol
CID 28766943
1-(4-chloro-3-fluorophenyl)-2-pyridin-2-ylpropan-1-ol
CID 107995597
1-(2-methoxy-5-methylphenyl)-2-pyridin-2-ylpropan-1-ol
CID 66459919
(1S)-2-methyl-1-pyridin-2-ylpropan-1-ol
CID 51670363

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol?
The IUPAC name of 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol (CID 66459713) is 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol.
What is the SMILES notation for 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol?
The canonical SMILES for 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol is CC(c1ccccn1)C(O)c1cccc(Cl)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol?
The InChIKey is UJPUVZJOOYJAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c1-9(12-7-2-3-8-17-12)14(18)10-5-4-6-11(15)13(10)16/h2-9,14,18H,1H3.
What are the key properties of 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol?
1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol has a molecular weight of 282.17 g/mol, XLogP of 4.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dichlorophenyl)-2-pyridin-2-ylpropan-1-ol is sourced from PubChem (CID 66459713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).