(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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Related Compounds

US11267824, Example 42
CID 137499645
US11267824, Example 64
CID 137499694
US11267824, Example 63
CID 137500094
US11267824, Example 187
CID 149681008
US11267824, Example 186
CID 149681009
US11267824, Example 102
CID 149689411
US11267824, Example 143
CID 149905450
US11267824, Example 182
CID 150923093
US11267824, Example 163
CID 151030330
US11267824, Example 81
CID 151320595
US11267824, Example 112
CID 152045876
US11267824, Example 181
CID 152187490

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).