N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide

C14H9FN2O3S — CID 861981

IUPACN-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
SMILESO=C(Nc1nc(-c2cc(F)ccc2O)cs1)c1ccco1
InChIInChI=1S/C14H9FN2O3S/c15-8-3-4-11(18)9(6-8)10-7-21-14(16-10)17-13(19)12-2-1-5-20-12/h1-7,18H,(H,16,17,19)
InChIKeyRPHSOQHCQLXQAI-UHFFFAOYSA-N
MW304.30 g/mol
LogP3.50
Rot. Bonds3

About N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide

N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide (PubChem CID 861981) has the molecular formula C14H9FN2O3S and a molecular weight of 304.30 g/mol. Its IUPAC name is N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
PubChem CID861981
Molecular FormulaC14H9FN2O3S
Molecular Weight304.30 g/mol
Exact Mass304.03
IUPAC NameN-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
SMILESO=C(Nc1nc(-c2cc(F)ccc2O)cs1)c1ccco1
InChIInChI=1S/C14H9FN2O3S/c15-8-3-4-11(18)9(6-8)10-7-21-14(16-10)17-13(19)12-2-1-5-20-12/h1-7,18H,(H,16,17,19)
InChIKeyRPHSOQHCQLXQAI-UHFFFAOYSA-N
XLogP3.50
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.30
LogP ≤ 53.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[[4-(3-fluorophenyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]furan-2-carboxamide
CID 55822951
N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 4061506
N-[4-[4-(5-fluoro-2-methoxyphenyl)-1,3-thiazol-2-yl]phenyl]furan-2-carboxamide
CID 9422983
N-[4-[[[4-(4-fluorophenyl)-1,3-thiazol-2-yl]amino]methyl]phenyl]furan-2-carboxamide
CID 133370970
2-bromo-N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]benzamide
CID 8839157
N-(4-ethyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 87065618
N-[4-[4-(2-methylpropyl)phenyl]-1,3-thiazol-2-yl]furan-2-carboxamide
CID 3602054
1-N,4-N-bis[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]benzene-1,4-dicarboxamide
CID 4116905
N-[4-(6-chloro-2,2-dimethylchromen-8-yl)-1,3-thiazol-2-yl]furan-2-carboxamide
CID 171780461
N-[4-(3-fluorophenyl)-1,3-thiazol-2-yl]-1,2-oxazole-5-carboxamide
CID 153338918
N-[4-(2,4-difluorophenyl)-1,3-thiazol-2-yl]-4-fluorobenzamide
CID 3524198
1-benzyl-N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]triazole-4-carboxamide
CID 31772694

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide?
The IUPAC name of N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide (CID 861981) is N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide is O=C(Nc1nc(-c2cc(F)ccc2O)cs1)c1ccco1.
What is the InChIKey of N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide?
The InChIKey is RPHSOQHCQLXQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O3S/c15-8-3-4-11(18)9(6-8)10-7-21-14(16-10)17-13(19)12-2-1-5-20-12/h1-7,18H,(H,16,17,19).
What are the key properties of N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide?
N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide has a molecular weight of 304.30 g/mol, XLogP of 3.50, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-fluoro-2-hydroxyphenyl)-1,3-thiazol-2-yl]furan-2-carboxamide is sourced from PubChem (CID 861981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).