pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol

C10H7F3N2OS — CID 112745523

IUPACpyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol
SMILESOC(c1cnccn1)c1cscc1C(F)(F)F
InChIInChI=1S/C10H7F3N2OS/c11-10(12,13)7-5-17-4-6(7)9(16)8-3-14-1-2-15-8/h1-5,9,16H
InChIKeyMQYYHSFIVSOMCJ-UHFFFAOYSA-N
MW260.24 g/mol
LogP2.64
Rot. Bonds2

About pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol

pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol (PubChem CID 112745523) has the molecular formula C10H7F3N2OS and a molecular weight of 260.24 g/mol. Its IUPAC name is pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol.

Molecular Properties

Compound Namepyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol
PubChem CID112745523
Molecular FormulaC10H7F3N2OS
Molecular Weight260.24 g/mol
Exact Mass260.02
IUPAC Namepyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol
SMILESOC(c1cnccn1)c1cscc1C(F)(F)F
InChIInChI=1S/C10H7F3N2OS/c11-10(12,13)7-5-17-4-6(7)9(16)8-3-14-1-2-15-8/h1-5,9,16H
InChIKeyMQYYHSFIVSOMCJ-UHFFFAOYSA-N
XLogP2.64
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-bromo-2-(trifluoromethyl)phenyl]-pyrazin-2-ylmethanol
CID 63968386
pyrazin-2-yl(quinolin-4-yl)methanol
CID 63969428
(2,4-dichlorophenyl)-pyrazin-2-ylmethanol
CID 63970677
pyrazin-2-yl(1,2-thiazol-5-yl)methanol
CID 131172108
(1S)-2,2,2-trifluoro-1-pyrazin-2-ylethanamine
CID 55293918
(2-chloro-4-methylphenyl)-pyrazin-2-ylmethanol
CID 106859248
3-[hydroxy(pyridin-2-yl)methyl]-4-(trifluoromethyl)phenol
CID 155099237
(4-methylthiadiazol-5-yl)-pyrazin-2-ylmethanol
CID 105099110
2-methyl-2-methylsulfanyl-1-pyrazin-2-ylpropan-1-ol
CID 127002734
(4-bromophenyl)-pyrazin-2-ylmethanol
CID 63970462
[4-(trifluoromethyl)-3-pyridinyl]methanediol
CID 162592484
[[2-fluoro-3-(trifluoromethyl)phenyl]-pyrazin-2-ylmethyl]hydrazine
CID 105250401

Frequently Asked Questions

What is the IUPAC name of pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol?
The IUPAC name of pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol (CID 112745523) is pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol.
What is the SMILES notation for pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol?
The canonical SMILES for pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol is OC(c1cnccn1)c1cscc1C(F)(F)F.
What is the InChIKey of pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol?
The InChIKey is MQYYHSFIVSOMCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2OS/c11-10(12,13)7-5-17-4-6(7)9(16)8-3-14-1-2-15-8/h1-5,9,16H.
What are the key properties of pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol?
pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol has a molecular weight of 260.24 g/mol, XLogP of 2.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyrazin-2-yl-[4-(trifluoromethyl)thiophen-3-yl]methanol is sourced from PubChem (CID 112745523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).