(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol

C10H10N2OS — CID 63968588

IUPAC(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol
SMILESCc1ccc(C(O)c2cnccn2)s1
InChIInChI=1S/C10H10N2OS/c1-7-2-3-9(14-7)10(13)8-6-11-4-5-12-8/h2-6,10,13H,1H3
InChIKeyQJUOMLHQXHKVCT-UHFFFAOYSA-N
MW206.27 g/mol
LogP1.93
Rot. Bonds2

About (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol

(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol (PubChem CID 63968588) has the molecular formula C10H10N2OS and a molecular weight of 206.27 g/mol. Its IUPAC name is (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol.

Molecular Properties

Compound Name(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol
PubChem CID63968588
Molecular FormulaC10H10N2OS
Molecular Weight206.27 g/mol
Exact Mass206.05
IUPAC Name(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol
SMILESCc1ccc(C(O)c2cnccn2)s1
InChIInChI=1S/C10H10N2OS/c1-7-2-3-9(14-7)10(13)8-6-11-4-5-12-8/h2-6,10,13H,1H3
InChIKeyQJUOMLHQXHKVCT-UHFFFAOYSA-N
XLogP1.93
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol?
The IUPAC name of (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol (CID 63968588) is (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol.
What is the SMILES notation for (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol?
The canonical SMILES for (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol is Cc1ccc(C(O)c2cnccn2)s1.
What is the InChIKey of (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol?
The InChIKey is QJUOMLHQXHKVCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2OS/c1-7-2-3-9(14-7)10(13)8-6-11-4-5-12-8/h2-6,10,13H,1H3.
What are the key properties of (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol?
(5-methylthiophen-2-yl)-pyrazin-2-ylmethanol has a molecular weight of 206.27 g/mol, XLogP of 1.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methylthiophen-2-yl)-pyrazin-2-ylmethanol is sourced from PubChem (CID 63968588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).