3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide

C16H15FN2O2 — CID 119037715

IUPAC3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCc2cc(F)ccc21)c1cc(C2CC2)no1
InChIInChI=1S/C16H15FN2O2/c17-11-4-5-12-10(7-11)3-6-13(12)18-16(20)15-8-14(19-21-15)9-1-2-9/h4-5,7-9,13H,1-3,6H2,(H,18,20)
InChIKeyFSWIPZSETRHTBB-UHFFFAOYSA-N
MW286.31 g/mol
LogP3.11
Rot. Bonds3

About 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide

3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide (PubChem CID 119037715) has the molecular formula C16H15FN2O2 and a molecular weight of 286.31 g/mol. Its IUPAC name is 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide
PubChem CID119037715
Molecular FormulaC16H15FN2O2
Molecular Weight286.31 g/mol
Exact Mass286.11
IUPAC Name3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCc2cc(F)ccc21)c1cc(C2CC2)no1
InChIInChI=1S/C16H15FN2O2/c17-11-4-5-12-10(7-11)3-6-13(12)18-16(20)15-8-14(19-21-15)9-1-2-9/h4-5,7-9,13H,1-3,6H2,(H,18,20)
InChIKeyFSWIPZSETRHTBB-UHFFFAOYSA-N
XLogP3.11
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.31
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide?
The IUPAC name of 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide (CID 119037715) is 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide is O=C(NC1CCc2cc(F)ccc21)c1cc(C2CC2)no1.
What is the InChIKey of 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide?
The InChIKey is FSWIPZSETRHTBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15FN2O2/c17-11-4-5-12-10(7-11)3-6-13(12)18-16(20)15-8-14(19-21-15)9-1-2-9/h4-5,7-9,13H,1-3,6H2,(H,18,20).
What are the key properties of 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide?
3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide has a molecular weight of 286.31 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-(5-fluoro-2,3-dihydro-1H-inden-1-yl)-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 119037715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).