N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide

C14H13FN2O2S — CID 3757551

IUPACN-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide
SMILESO=C(Nc1nc(-c2ccc(F)cc2)cs1)C1CCCO1
InChIInChI=1S/C14H13FN2O2S/c15-10-5-3-9(4-6-10)11-8-20-14(16-11)17-13(18)12-2-1-7-19-12/h3-6,8,12H,1-2,7H2,(H,16,17,18)
InChIKeyFRCMNKWDESUUSZ-UHFFFAOYSA-N
MW292.33 g/mol
LogP3.07
Rot. Bonds3

About N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide

N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide (PubChem CID 3757551) has the molecular formula C14H13FN2O2S and a molecular weight of 292.33 g/mol. Its IUPAC name is N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide
PubChem CID3757551
Molecular FormulaC14H13FN2O2S
Molecular Weight292.33 g/mol
Exact Mass292.07
IUPAC NameN-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide
SMILESO=C(Nc1nc(-c2ccc(F)cc2)cs1)C1CCCO1
InChIInChI=1S/C14H13FN2O2S/c15-10-5-3-9(4-6-10)11-8-20-14(16-11)17-13(18)12-2-1-7-19-12/h3-6,8,12H,1-2,7H2,(H,16,17,18)
InChIKeyFRCMNKWDESUUSZ-UHFFFAOYSA-N
XLogP3.07
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide?
The IUPAC name of N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide (CID 3757551) is N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide.
What is the SMILES notation for N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide?
The canonical SMILES for N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide is O=C(Nc1nc(-c2ccc(F)cc2)cs1)C1CCCO1.
What is the InChIKey of N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide?
The InChIKey is FRCMNKWDESUUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2S/c15-10-5-3-9(4-6-10)11-8-20-14(16-11)17-13(18)12-2-1-7-19-12/h3-6,8,12H,1-2,7H2,(H,16,17,18).
What are the key properties of N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide?
N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide has a molecular weight of 292.33 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(4-fluorophenyl)-1,3-thiazol-2-yl]oxolane-2-carboxamide is sourced from PubChem (CID 3757551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).