quinoxalin-5-yl(thiophen-3-yl)methanol

C13H10N2OS — CID 105102725

IUPACquinoxalin-5-yl(thiophen-3-yl)methanol
SMILESOC(c1ccsc1)c1cccc2nccnc12
InChIInChI=1S/C13H10N2OS/c16-13(9-4-7-17-8-9)10-2-1-3-11-12(10)15-6-5-14-11/h1-8,13,16H
InChIKeyDHABZEBYYXUYBU-UHFFFAOYSA-N
MW242.30 g/mol
LogP2.77
Rot. Bonds2

About quinoxalin-5-yl(thiophen-3-yl)methanol

quinoxalin-5-yl(thiophen-3-yl)methanol (PubChem CID 105102725) has the molecular formula C13H10N2OS and a molecular weight of 242.30 g/mol. Its IUPAC name is quinoxalin-5-yl(thiophen-3-yl)methanol.

Molecular Properties

Compound Namequinoxalin-5-yl(thiophen-3-yl)methanol
PubChem CID105102725
Molecular FormulaC13H10N2OS
Molecular Weight242.30 g/mol
Exact Mass242.05
IUPAC Namequinoxalin-5-yl(thiophen-3-yl)methanol
SMILESOC(c1ccsc1)c1cccc2nccnc12
InChIInChI=1S/C13H10N2OS/c16-13(9-4-7-17-8-9)10-2-1-3-11-12(10)15-6-5-14-11/h1-8,13,16H
InChIKeyDHABZEBYYXUYBU-UHFFFAOYSA-N
XLogP2.77
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.30
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(4-chlorophenyl)-quinoxalin-5-ylmethanol
CID 105120341
(3-chlorothiophen-2-yl)-quinoxalin-5-ylmethanol
CID 107361966
2-[hydroxy(thiophen-3-yl)methyl]phenol
CID 155686195
(3-ethoxyphenyl)-quinoxalin-5-ylmethanol
CID 105119584
(S)-(2-propan-2-ylphenyl)-thiophen-3-ylmethanol
CID 97293180
(3-bromo-2-chlorophenyl)-thiophen-3-ylmethanol
CID 115805570
(R)-(2-methoxyphenyl)-thiophen-3-ylmethanol
CID 93312294
(3-chloropyrazin-2-yl)-thiophen-3-ylmethanol
CID 119085250
(5-bromo-2-fluorophenyl)-quinoxalin-5-ylmethanol
CID 105113707
quinolin-8-yl(thiophen-3-yl)methanamine
CID 81220765
3,4-dihydro-2H-pyran-5-yl(quinoxalin-5-yl)methanol
CID 105124475
2,3-dihydro-1-benzofuran-7-yl(thiophen-3-yl)methanol
CID 114743275

Frequently Asked Questions

What is the IUPAC name of quinoxalin-5-yl(thiophen-3-yl)methanol?
The IUPAC name of quinoxalin-5-yl(thiophen-3-yl)methanol (CID 105102725) is quinoxalin-5-yl(thiophen-3-yl)methanol.
What is the SMILES notation for quinoxalin-5-yl(thiophen-3-yl)methanol?
The canonical SMILES for quinoxalin-5-yl(thiophen-3-yl)methanol is OC(c1ccsc1)c1cccc2nccnc12.
What is the InChIKey of quinoxalin-5-yl(thiophen-3-yl)methanol?
The InChIKey is DHABZEBYYXUYBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2OS/c16-13(9-4-7-17-8-9)10-2-1-3-11-12(10)15-6-5-14-11/h1-8,13,16H.
What are the key properties of quinoxalin-5-yl(thiophen-3-yl)methanol?
quinoxalin-5-yl(thiophen-3-yl)methanol has a molecular weight of 242.30 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for quinoxalin-5-yl(thiophen-3-yl)methanol is sourced from PubChem (CID 105102725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).