3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide

C17H14FN3O2 — CID 18136880

IUPAC3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide
SMILESO=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccccn1
InChIInChI=1S/C17H14FN3O2/c18-13-6-2-1-5-12(13)14-11-20-17(23-14)9-8-16(22)21-15-7-3-4-10-19-15/h1-7,10-11H,8-9H2,(H,19,21,22)
InChIKeyBMULELCCJILYJY-UHFFFAOYSA-N
MW311.32 g/mol
LogP3.45
Rot. Bonds5

About 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide

3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide (PubChem CID 18136880) has the molecular formula C17H14FN3O2 and a molecular weight of 311.32 g/mol. Its IUPAC name is 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide.

Molecular Properties

Compound Name3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide
PubChem CID18136880
Molecular FormulaC17H14FN3O2
Molecular Weight311.32 g/mol
Exact Mass311.11
IUPAC Name3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide
SMILESO=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccccn1
InChIInChI=1S/C17H14FN3O2/c18-13-6-2-1-5-12(13)14-11-20-17(23-14)9-8-16(22)21-15-7-3-4-10-19-15/h1-7,10-11H,8-9H2,(H,19,21,22)
InChIKeyBMULELCCJILYJY-UHFFFAOYSA-N
XLogP3.45
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.32
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide?
The IUPAC name of 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide (CID 18136880) is 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide.
What is the SMILES notation for 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide?
The canonical SMILES for 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide is O=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccccn1.
What is the InChIKey of 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide?
The InChIKey is BMULELCCJILYJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FN3O2/c18-13-6-2-1-5-12(13)14-11-20-17(23-14)9-8-16(22)21-15-7-3-4-10-19-15/h1-7,10-11H,8-9H2,(H,19,21,22).
What are the key properties of 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide?
3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide has a molecular weight of 311.32 g/mol, XLogP of 3.45, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-pyridin-2-ylpropanamide is sourced from PubChem (CID 18136880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).