(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol

C9H8FNOS2 — CID 130653495

IUPAC(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)c2sccc2F)sn1
InChIInChI=1S/C9H8FNOS2/c1-5-4-7(14-11-5)8(12)9-6(10)2-3-13-9/h2-4,8,12H,1H3
InChIKeyDMOMIGCRSJKRKN-UHFFFAOYSA-N
MW229.30 g/mol
LogP2.73
Rot. Bonds2

About (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol

(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol (PubChem CID 130653495) has the molecular formula C9H8FNOS2 and a molecular weight of 229.30 g/mol. Its IUPAC name is (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol.

Molecular Properties

Compound Name(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
PubChem CID130653495
Molecular FormulaC9H8FNOS2
Molecular Weight229.30 g/mol
Exact Mass229.00
IUPAC Name(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
SMILESCc1cc(C(O)c2sccc2F)sn1
InChIInChI=1S/C9H8FNOS2/c1-5-4-7(14-11-5)8(12)9-6(10)2-3-13-9/h2-4,8,12H,1H3
InChIKeyDMOMIGCRSJKRKN-UHFFFAOYSA-N
XLogP2.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3-Thiophen-3-yl-1,2-thiazol-5-yl)methanol
CID 19744568
1-(3-Methyl-1,2-thiazol-5-yl)-1-thiophen-3-ylethanol
CID 127003878
(3-Chlorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 130604815
(3-Methyl-1,2-thiazol-5-yl)-(2-methylthiophen-3-yl)methanol
CID 130604946
(5-Ethylthiophen-2-yl)-(1,2-thiazol-3-yl)methanol
CID 130625390
(5-Bromothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol
CID 130626593
(2-Methylthiophen-3-yl)-(1,2-thiazol-3-yl)methanol
CID 130631086
1,2-Thiazol-3-yl(thiophen-2-yl)methanol
CID 130658815
(3-Ethylthiophen-2-yl)-(1,2-thiazol-3-yl)methanol
CID 130736495
(3-Methyl-1,2-thiazol-5-yl)-(5-methylthiophen-2-yl)methanol
CID 130847439
(3-Bromothiophen-2-yl)-(1,2-thiazol-3-yl)methanol
CID 130906083
(3-Methyl-1,2-thiazol-5-yl)-(thiolan-2-yl)methanol
CID 131020689

Frequently Asked Questions

What is the IUPAC name of (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The IUPAC name of (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol (CID 130653495) is (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol.
What is the SMILES notation for (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The canonical SMILES for (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol is Cc1cc(C(O)c2sccc2F)sn1.
What is the InChIKey of (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol?
The InChIKey is DMOMIGCRSJKRKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8FNOS2/c1-5-4-7(14-11-5)8(12)9-6(10)2-3-13-9/h2-4,8,12H,1H3.
What are the key properties of (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol?
(3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol has a molecular weight of 229.30 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluorothiophen-2-yl)-(3-methyl-1,2-thiazol-5-yl)methanol is sourced from PubChem (CID 130653495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).