2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide

C17H13FN2O2 — CID 110429071

IUPAC2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccc3)ccc2F)no1
InChIInChI=1S/C17H13FN2O2/c1-11-9-16(20-22-11)19-17(21)14-10-13(7-8-15(14)18)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20,21)
InChIKeyFITHDLLAXWEWPN-UHFFFAOYSA-N
MW296.30 g/mol
LogP4.04
Rot. Bonds3

About 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide

2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide (PubChem CID 110429071) has the molecular formula C17H13FN2O2 and a molecular weight of 296.30 g/mol. Its IUPAC name is 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide
PubChem CID110429071
Molecular FormulaC17H13FN2O2
Molecular Weight296.30 g/mol
Exact Mass296.10
IUPAC Name2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide
SMILESCc1cc(NC(=O)c2cc(-c3ccccc3)ccc2F)no1
InChIInChI=1S/C17H13FN2O2/c1-11-9-16(20-22-11)19-17(21)14-10-13(7-8-15(14)18)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20,21)
InChIKeyFITHDLLAXWEWPN-UHFFFAOYSA-N
XLogP4.04
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.30
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-fluoro-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62509692
N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 569560
3-fluoro-2-(methylamino)-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62649569
3-fluoro-N-(5-methyl-1,2-oxazol-3-yl)pyridine-4-carboxamide
CID 115646253
6-chloro-2-methyl-N-(5-methyl-1,2-oxazol-3-yl)-4-phenylquinoline-3-carboxamide
CID 24614620
3-chloro-4-fluoro-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 110764772
2-(4-bromophenyl)-N-(5-methyl-1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 1358287
4-methyl-N-(5-methyl-1,2-oxazol-3-yl)-2-phenyl-1,3-thiazole-5-carboxamide
CID 17398337
2-ethylsulfanyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 970322
5-amino-2-bromo-4-fluoro-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62831072
N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-4-phenylbenzamide
CID 51267288
2-(4-ethylphenyl)-N-(5-methyl-1,2-oxazol-3-yl)quinoline-4-carboxamide
CID 4095752

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide?
The IUPAC name of 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide (CID 110429071) is 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide.
What is the SMILES notation for 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide?
The canonical SMILES for 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide is Cc1cc(NC(=O)c2cc(-c3ccccc3)ccc2F)no1.
What is the InChIKey of 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide?
The InChIKey is FITHDLLAXWEWPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13FN2O2/c1-11-9-16(20-22-11)19-17(21)14-10-13(7-8-15(14)18)12-5-3-2-4-6-12/h2-10H,1H3,(H,19,20,21).
What are the key properties of 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide?
2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide has a molecular weight of 296.30 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(5-methyl-1,2-oxazol-3-yl)-5-phenylbenzamide is sourced from PubChem (CID 110429071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).