2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide

C17H15FN2O2S — CID 42570925

IUPAC2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccc2F)sc1C(=O)NCCc1ccco1
InChIInChI=1S/C17H15FN2O2S/c1-11-15(16(21)19-9-8-12-5-4-10-22-12)23-17(20-11)13-6-2-3-7-14(13)18/h2-7,10H,8-9H2,1H3,(H,19,21)
InChIKeyUOAUDEDZRCIATE-UHFFFAOYSA-N
MW330.38 g/mol
LogP3.82
Rot. Bonds5

About 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide

2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide (PubChem CID 42570925) has the molecular formula C17H15FN2O2S and a molecular weight of 330.38 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
PubChem CID42570925
Molecular FormulaC17H15FN2O2S
Molecular Weight330.38 g/mol
Exact Mass330.08
IUPAC Name2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide
SMILESCc1nc(-c2ccccc2F)sc1C(=O)NCCc1ccco1
InChIInChI=1S/C17H15FN2O2S/c1-11-15(16(21)19-9-8-12-5-4-10-22-12)23-17(20-11)13-6-2-3-7-14(13)18/h2-7,10H,8-9H2,1H3,(H,19,21)
InChIKeyUOAUDEDZRCIATE-UHFFFAOYSA-N
XLogP3.82
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide (CID 42570925) is 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide is Cc1nc(-c2ccccc2F)sc1C(=O)NCCc1ccco1.
What is the InChIKey of 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide?
The InChIKey is UOAUDEDZRCIATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15FN2O2S/c1-11-15(16(21)19-9-8-12-5-4-10-22-12)23-17(20-11)13-6-2-3-7-14(13)18/h2-7,10H,8-9H2,1H3,(H,19,21).
What are the key properties of 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide?
2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide has a molecular weight of 330.38 g/mol, XLogP of 3.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[2-(furan-2-yl)ethyl]-4-methyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 42570925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).