2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide

C18H16FN3O2 — CID 110296524

IUPAC2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
SMILESCc1cc(NC(=O)C(Cc2cccnc2)c2ccc(F)cc2)no1
InChIInChI=1S/C18H16FN3O2/c1-12-9-17(22-24-12)21-18(23)16(10-13-3-2-8-20-11-13)14-4-6-15(19)7-5-14/h2-9,11,16H,10H2,1H3,(H,21,22,23)
InChIKeyUKDZHTSQTYLFSM-UHFFFAOYSA-N
MW325.34 g/mol
LogP3.48
Rot. Bonds5

About 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide

2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide (PubChem CID 110296524) has the molecular formula C18H16FN3O2 and a molecular weight of 325.34 g/mol. Its IUPAC name is 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
PubChem CID110296524
Molecular FormulaC18H16FN3O2
Molecular Weight325.34 g/mol
Exact Mass325.12
IUPAC Name2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide
SMILESCc1cc(NC(=O)C(Cc2cccnc2)c2ccc(F)cc2)no1
InChIInChI=1S/C18H16FN3O2/c1-12-9-17(22-24-12)21-18(23)16(10-13-3-2-8-20-11-13)14-4-6-15(19)7-5-14/h2-9,11,16H,10H2,1H3,(H,21,22,23)
InChIKeyUKDZHTSQTYLFSM-UHFFFAOYSA-N
XLogP3.48
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.34
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide?
The IUPAC name of 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide (CID 110296524) is 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide.
What is the SMILES notation for 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide?
The canonical SMILES for 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide is Cc1cc(NC(=O)C(Cc2cccnc2)c2ccc(F)cc2)no1.
What is the InChIKey of 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide?
The InChIKey is UKDZHTSQTYLFSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O2/c1-12-9-17(22-24-12)21-18(23)16(10-13-3-2-8-20-11-13)14-4-6-15(19)7-5-14/h2-9,11,16H,10H2,1H3,(H,21,22,23).
What are the key properties of 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide?
2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide has a molecular weight of 325.34 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)-N-(5-methyl-1,2-oxazol-3-yl)-3-pyridin-3-ylpropanamide is sourced from PubChem (CID 110296524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).