N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide

C14H9FN2O2S — CID 36654704

IUPACN-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1csc(-c2ccco2)n1
InChIInChI=1S/C14H9FN2O2S/c15-9-3-1-4-10(7-9)16-13(18)11-8-20-14(17-11)12-5-2-6-19-12/h1-8H,(H,16,18)
InChIKeyNMYVBUBNJKEXIU-UHFFFAOYSA-N
MW288.30 g/mol
LogP3.79
Rot. Bonds3

About N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide

N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide (PubChem CID 36654704) has the molecular formula C14H9FN2O2S and a molecular weight of 288.30 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
PubChem CID36654704
Molecular FormulaC14H9FN2O2S
Molecular Weight288.30 g/mol
Exact Mass288.04
IUPAC NameN-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1csc(-c2ccco2)n1
InChIInChI=1S/C14H9FN2O2S/c15-9-3-1-4-10(7-9)16-13(18)11-8-20-14(17-11)12-5-2-6-19-12/h1-8H,(H,16,18)
InChIKeyNMYVBUBNJKEXIU-UHFFFAOYSA-N
XLogP3.79
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.30
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(furan-2-yl)-N-[4-(methylcarbamoyl)phenyl]-1,3-thiazole-4-carboxamide
CID 36769984
N-[4-(cyclopropanecarbonylamino)phenyl]-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 36817379
N-[3-(difluoromethoxy)-4-methoxyphenyl]-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 36862622
N-(3-fluorophenyl)-6-(furan-2-yl)-2-oxo-1H-pyrimidine-4-carboxamide
CID 110331954
2-(furan-2-yl)-N'-[3-(trifluoromethyl)phenyl]-1,3-thiazole-4-carbohydrazide
CID 55554329
N-[3-chloro-4-(cyclopropylcarbamoyl)phenyl]-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 55804728
2-(furan-2-yl)-N-(4-methyl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 36703482
2-(furan-2-yl)-N-(2H-tetrazol-5-yl)-1,3-thiazole-4-carboxamide
CID 15623144
N-(5-bromo-2-methylphenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide
CID 52655029
2-(furan-2-yl)-N-(5-phenyl-1,3,4-thiadiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 36808320
2-(furan-2-yl)-N-(5-methyl-1H-1,2,4-triazol-3-yl)-1,3-thiazole-4-carboxamide
CID 78927834
2-(furan-2-yl)-N-(5-propyl-1H-pyrazol-3-yl)-1,3-thiazole-4-carboxamide
CID 115619787

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide (CID 36654704) is N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide is O=C(Nc1cccc(F)c1)c1csc(-c2ccco2)n1.
What is the InChIKey of N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide?
The InChIKey is NMYVBUBNJKEXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2S/c15-9-3-1-4-10(7-9)16-13(18)11-8-20-14(17-11)12-5-2-6-19-12/h1-8H,(H,16,18).
What are the key properties of N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide?
N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide has a molecular weight of 288.30 g/mol, XLogP of 3.79, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-(furan-2-yl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 36654704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).