(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol

C15H13FN2OS — CID 151109135

IUPAC(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol
SMILESOC(c1cccc(F)c1)c1c(C2CC2)sc2cncn12
InChIInChI=1S/C15H13FN2OS/c16-11-3-1-2-10(6-11)14(19)13-15(9-4-5-9)20-12-7-17-8-18(12)13/h1-3,6-9,14,19H,4-5H2
InChIKeyMPSZPDNCYDWQCO-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.49
Rot. Bonds3

About (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol

(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol (PubChem CID 151109135) has the molecular formula C15H13FN2OS and a molecular weight of 288.35 g/mol. Its IUPAC name is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol.

Molecular Properties

Compound Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol
PubChem CID151109135
Molecular FormulaC15H13FN2OS
Molecular Weight288.35 g/mol
Exact Mass288.07
IUPAC Name(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol
SMILESOC(c1cccc(F)c1)c1c(C2CC2)sc2cncn12
InChIInChI=1S/C15H13FN2OS/c16-11-3-1-2-10(6-11)14(19)13-15(9-4-5-9)20-12-7-17-8-18(12)13/h1-3,6-9,14,19H,4-5H2
InChIKeyMPSZPDNCYDWQCO-UHFFFAOYSA-N
XLogP3.49
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol?
The IUPAC name of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol (CID 151109135) is (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol.
What is the SMILES notation for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol?
The canonical SMILES for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol is OC(c1cccc(F)c1)c1c(C2CC2)sc2cncn12.
What is the InChIKey of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol?
The InChIKey is MPSZPDNCYDWQCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13FN2OS/c16-11-3-1-2-10(6-11)14(19)13-15(9-4-5-9)20-12-7-17-8-18(12)13/h1-3,6-9,14,19H,4-5H2.
What are the key properties of (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol?
(2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol has a molecular weight of 288.35 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-cyclopropylimidazo[5,1-b][1,3]thiazol-3-yl)-(3-fluorophenyl)methanol is sourced from PubChem (CID 151109135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).