[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol

C14H14FNOS — CID 116865623

IUPAC[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol
SMILESOCC1(c2nc(-c3ccccc3F)cs2)CCC1
InChIInChI=1S/C14H14FNOS/c15-11-5-2-1-4-10(11)12-8-18-13(16-12)14(9-17)6-3-7-14/h1-2,4-5,8,17H,3,6-7,9H2
InChIKeyLNWWRWRFXWAAEO-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.36
Rot. Bonds3

About [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol

[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol (PubChem CID 116865623) has the molecular formula C14H14FNOS and a molecular weight of 263.34 g/mol. Its IUPAC name is [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol.

Molecular Properties

Compound Name[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol
PubChem CID116865623
Molecular FormulaC14H14FNOS
Molecular Weight263.34 g/mol
Exact Mass263.08
IUPAC Name[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol
SMILESOCC1(c2nc(-c3ccccc3F)cs2)CCC1
InChIInChI=1S/C14H14FNOS/c15-11-5-2-1-4-10(11)12-8-18-13(16-12)14(9-17)6-3-7-14/h1-2,4-5,8,17H,3,6-7,9H2
InChIKeyLNWWRWRFXWAAEO-UHFFFAOYSA-N
XLogP3.36
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol?
The IUPAC name of [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol (CID 116865623) is [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol.
What is the SMILES notation for [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol?
The canonical SMILES for [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol is OCC1(c2nc(-c3ccccc3F)cs2)CCC1.
What is the InChIKey of [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol?
The InChIKey is LNWWRWRFXWAAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNOS/c15-11-5-2-1-4-10(11)12-8-18-13(16-12)14(9-17)6-3-7-14/h1-2,4-5,8,17H,3,6-7,9H2.
What are the key properties of [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol?
[1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol has a molecular weight of 263.34 g/mol, XLogP of 3.36, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[4-(2-fluorophenyl)-1,3-thiazol-2-yl]cyclobutyl]methanol is sourced from PubChem (CID 116865623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).