2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol

C12H10Cl2N2O — CID 62489843

IUPAC2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol
SMILESOC(Cc1c(Cl)cccc1Cl)c1cncnc1
InChIInChI=1S/C12H10Cl2N2O/c13-10-2-1-3-11(14)9(10)4-12(17)8-5-15-7-16-6-8/h1-3,5-7,12,17H,4H2
InChIKeyHAZYUBDVDGRNAZ-UHFFFAOYSA-N
MW269.13 g/mol
LogP3.06
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol

2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol (PubChem CID 62489843) has the molecular formula C12H10Cl2N2O and a molecular weight of 269.13 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol
PubChem CID62489843
Molecular FormulaC12H10Cl2N2O
Molecular Weight269.13 g/mol
Exact Mass268.02
IUPAC Name2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol
SMILESOC(Cc1c(Cl)cccc1Cl)c1cncnc1
InChIInChI=1S/C12H10Cl2N2O/c13-10-2-1-3-11(14)9(10)4-12(17)8-5-15-7-16-6-8/h1-3,5-7,12,17H,4H2
InChIKeyHAZYUBDVDGRNAZ-UHFFFAOYSA-N
XLogP3.06
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.13
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanamine
CID 55078463
2-(2,6-dichlorophenyl)-1-pyrimidin-2-ylethanol
CID 62606143
2-(2,6-dichlorophenyl)-1-(4-ethylphenyl)ethanol
CID 55187735
2-(2-chloro-6-fluorophenyl)-1-pyridin-4-ylethanol
CID 61495940
[2-(2,6-dichlorophenyl)-1-pyridin-3-ylethyl]hydrazine
CID 105196072
2-(3-methylphenyl)-1-pyrimidin-5-ylethanol
CID 62491693
2-(2,6-dichlorophenyl)-1-thieno[3,2-b]pyridin-6-ylethanol
CID 81143648
1-(2,6-dichlorophenyl)-3-(1,3-thiazol-5-yl)propan-2-ol
CID 112642505
[2-(2,6-dichlorophenyl)-1-(5-fluoro-3-pyridinyl)ethyl]hydrazine
CID 105209818
2-(2-bromo-3-fluorophenyl)-1-pyrimidin-5-ylethanol
CID 102924092
1-(3-chloro-2-methylphenyl)-2-(2,6-dichlorophenyl)ethanol
CID 107103304
2-(2,6-dichlorophenyl)-1-(3-propan-2-yloxyphenyl)ethanol
CID 65145651

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol?
The IUPAC name of 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol (CID 62489843) is 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol?
The canonical SMILES for 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol is OC(Cc1c(Cl)cccc1Cl)c1cncnc1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol?
The InChIKey is HAZYUBDVDGRNAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2O/c13-10-2-1-3-11(14)9(10)4-12(17)8-5-15-7-16-6-8/h1-3,5-7,12,17H,4H2.
What are the key properties of 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol?
2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol has a molecular weight of 269.13 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanol is sourced from PubChem (CID 62489843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).