(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol

C8H8FN3OS — CID 130603747

IUPAC(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol
SMILESCn1ncc(C(O)c2sccc2F)n1
InChIInChI=1S/C8H8FN3OS/c1-12-10-4-6(11-12)7(13)8-5(9)2-3-14-8/h2-4,7,13H,1H3
InChIKeyDYDXFTQOVNOJGF-UHFFFAOYSA-N
MW213.24 g/mol
LogP1.10
Rot. Bonds2

About (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol

(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol (PubChem CID 130603747) has the molecular formula C8H8FN3OS and a molecular weight of 213.24 g/mol. Its IUPAC name is (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol.

Molecular Properties

Compound Name(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol
PubChem CID130603747
Molecular FormulaC8H8FN3OS
Molecular Weight213.24 g/mol
Exact Mass213.04
IUPAC Name(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol
SMILESCn1ncc(C(O)c2sccc2F)n1
InChIInChI=1S/C8H8FN3OS/c1-12-10-4-6(11-12)7(13)8-5(9)2-3-14-8/h2-4,7,13H,1H3
InChIKeyDYDXFTQOVNOJGF-UHFFFAOYSA-N
XLogP1.10
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol 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-Methyltriazol-4-yl)-[4-(trifluoromethyl)thiophen-3-yl]methanol
CID 112745722
(3-Fluorothiophen-2-yl)-(3-methyltriazol-4-yl)methanol
CID 130594760
(3-methylthiophen-2-yl)-(2H-triazol-4-yl)methanol
CID 80494600
(5-methylthiophen-3-yl)-(2H-triazol-4-yl)methanol
CID 80494626
(5-methylthiophen-2-yl)-(2H-triazol-4-yl)methanol
CID 80494698
2-(3-bromothiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494726
(3-bromothiophen-2-yl)-(2H-triazol-4-yl)methanol
CID 80494779
2-thiophen-2-yl-1-(2H-triazol-4-yl)ethanol
CID 80494847
thiophen-2-yl(2H-triazol-4-yl)methanol
CID 80494902
2-(5-ethylthiophen-2-yl)-1-(2H-triazol-4-yl)ethanol
CID 80494933
(5-chlorothiophen-2-yl)-(2H-triazol-4-yl)methanol
CID 80494968
3-thiophen-2-yl-1-(2H-triazol-4-yl)propan-1-ol
CID 80494972

Frequently Asked Questions

What is the IUPAC name of (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol?
The IUPAC name of (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol (CID 130603747) is (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol.
What is the SMILES notation for (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol?
The canonical SMILES for (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol is Cn1ncc(C(O)c2sccc2F)n1.
What is the InChIKey of (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol?
The InChIKey is DYDXFTQOVNOJGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8FN3OS/c1-12-10-4-6(11-12)7(13)8-5(9)2-3-14-8/h2-4,7,13H,1H3.
What are the key properties of (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol?
(3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol has a molecular weight of 213.24 g/mol, XLogP of 1.10, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorothiophen-2-yl)-(2-methyltriazol-4-yl)methanol is sourced from PubChem (CID 130603747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).