N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide

C14H9FN2O2S — CID 35342222

IUPACN-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide
SMILESO=C(Nc1cc(-c2ccc(F)cc2)no1)c1cccs1
InChIInChI=1S/C14H9FN2O2S/c15-10-5-3-9(4-6-10)11-8-13(19-17-11)16-14(18)12-2-1-7-20-12/h1-8H,(H,16,18)
InChIKeyNCYVNWPALHMIDA-UHFFFAOYSA-N
MW288.30 g/mol
LogP3.79
Rot. Bonds3

About N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide

N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide (PubChem CID 35342222) has the molecular formula C14H9FN2O2S and a molecular weight of 288.30 g/mol. Its IUPAC name is N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide
PubChem CID35342222
Molecular FormulaC14H9FN2O2S
Molecular Weight288.30 g/mol
Exact Mass288.04
IUPAC NameN-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide
SMILESO=C(Nc1cc(-c2ccc(F)cc2)no1)c1cccs1
InChIInChI=1S/C14H9FN2O2S/c15-10-5-3-9(4-6-10)11-8-13(19-17-11)16-14(18)12-2-1-7-20-12/h1-8H,(H,16,18)
InChIKeyNCYVNWPALHMIDA-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

N-[3-(furan-2-yl)-1,2-oxazol-5-yl]thiophene-2-carboxamide
CID 53143213
N-[4-[5-(4-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]thiophene-2-carboxamide
CID 2203267
[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl] 2-(thiophene-2-carbonylamino)acetate
CID 7519386
N-(2-bromo-4-fluorophenyl)thiophene-2-carboxamide
CID 28938543
3-fluoro-N-(3-thiophen-3-yl-1,2-oxazol-5-yl)benzamide
CID 53143326
N-[2-acetyl-5-(4-fluorophenyl)thiophen-3-yl]thiophene-2-carboxamide
CID 2809109
N-(3,5-difluorophenyl)thiophene-2-carboxamide
CID 2986846
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-2,5-difluorobenzamide
CID 56569806
N-[4-(4-fluorophenyl)-5-methyl-1,3-thiazol-2-yl]thiophene-2-carboxamide
CID 3151931
N-(2,4,5-trifluorophenyl)thiophene-2-carboxamide
CID 63372873
N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]-4-pentoxybenzamide
CID 35344022
N-[2-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]ethyl]thiophene-2-carboxamide
CID 83289766

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The IUPAC name of N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide (CID 35342222) is N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide.
What is the SMILES notation for N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The canonical SMILES for N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide is O=C(Nc1cc(-c2ccc(F)cc2)no1)c1cccs1.
What is the InChIKey of N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide?
The InChIKey is NCYVNWPALHMIDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9FN2O2S/c15-10-5-3-9(4-6-10)11-8-13(19-17-11)16-14(18)12-2-1-7-20-12/h1-8H,(H,16,18).
What are the key properties of N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide?
N-[3-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-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-(4-fluorophenyl)-1,2-oxazol-5-yl]thiophene-2-carboxamide is sourced from PubChem (CID 35342222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).