(4-chlorophenyl)-quinoxalin-5-ylmethanol

C15H11ClN2O — CID 105120341

IUPAC(4-chlorophenyl)-quinoxalin-5-ylmethanol
SMILESOC(c1ccc(Cl)cc1)c1cccc2nccnc12
InChIInChI=1S/C15H11ClN2O/c16-11-6-4-10(5-7-11)15(19)12-2-1-3-13-14(12)18-9-8-17-13/h1-9,15,19H
InChIKeyZKDVKSZBDYNNTM-UHFFFAOYSA-N
MW270.72 g/mol
LogP3.36
Rot. Bonds2

About (4-chlorophenyl)-quinoxalin-5-ylmethanol

(4-chlorophenyl)-quinoxalin-5-ylmethanol (PubChem CID 105120341) has the molecular formula C15H11ClN2O and a molecular weight of 270.72 g/mol. Its IUPAC name is (4-chlorophenyl)-quinoxalin-5-ylmethanol.

Molecular Properties

Compound Name(4-chlorophenyl)-quinoxalin-5-ylmethanol
PubChem CID105120341
Molecular FormulaC15H11ClN2O
Molecular Weight270.72 g/mol
Exact Mass270.06
IUPAC Name(4-chlorophenyl)-quinoxalin-5-ylmethanol
SMILESOC(c1ccc(Cl)cc1)c1cccc2nccnc12
InChIInChI=1S/C15H11ClN2O/c16-11-6-4-10(5-7-11)15(19)12-2-1-3-13-14(12)18-9-8-17-13/h1-9,15,19H
InChIKeyZKDVKSZBDYNNTM-UHFFFAOYSA-N
XLogP3.36
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.72
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

quinoxalin-5-yl(thiophen-3-yl)methanol
CID 105102725
(3-chlorothiophen-2-yl)-quinoxalin-5-ylmethanol
CID 107361966
(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol
CID 105113707
(3-ethoxyphenyl)-quinoxalin-5-ylmethanol
CID 105119584
2-(2,4-dichlorophenyl)-1-quinoxalin-5-ylethanol
CID 105086789
1-quinoxalin-5-ylprop-2-yn-1-ol
CID 105106188
[2-(4-chlorophenyl)-1-quinoxalin-5-ylethyl]hydrazine
CID 105283316
(2,5-dichlorophenyl)-quinoxalin-5-ylmethanamine
CID 105142151
2-(2-chloro-3-fluorophenyl)-1-quinoxalin-5-ylethanol
CID 105124141
(S)-(4-chlorophenyl)-naphthalen-1-ylmethanol
CID 93489560
(4-chlorophenyl)-(2-methylquinolin-4-yl)methanol
CID 79234879
(4-chlorophenyl)-isoquinolin-8-ylmethanol
CID 103139329

Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-quinoxalin-5-ylmethanol?
The IUPAC name of (4-chlorophenyl)-quinoxalin-5-ylmethanol (CID 105120341) is (4-chlorophenyl)-quinoxalin-5-ylmethanol.
What is the SMILES notation for (4-chlorophenyl)-quinoxalin-5-ylmethanol?
The canonical SMILES for (4-chlorophenyl)-quinoxalin-5-ylmethanol is OC(c1ccc(Cl)cc1)c1cccc2nccnc12.
What is the InChIKey of (4-chlorophenyl)-quinoxalin-5-ylmethanol?
The InChIKey is ZKDVKSZBDYNNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O/c16-11-6-4-10(5-7-11)15(19)12-2-1-3-13-14(12)18-9-8-17-13/h1-9,15,19H.
What are the key properties of (4-chlorophenyl)-quinoxalin-5-ylmethanol?
(4-chlorophenyl)-quinoxalin-5-ylmethanol has a molecular weight of 270.72 g/mol, XLogP of 3.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-quinoxalin-5-ylmethanol is sourced from PubChem (CID 105120341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).