5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide

C14H16F3N5O2 — CID 167939518

IUPAC5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1cnn(CC(F)(F)F)c1)c1ncoc1C1CCNCC1
InChIInChI=1S/C14H16F3N5O2/c15-14(16,17)7-22-6-10(5-20-22)21-13(23)11-12(24-8-19-11)9-1-3-18-4-2-9/h5-6,8-9,18H,1-4,7H2,(H,21,23)
InChIKeySNZUCHYSZYDYMT-UHFFFAOYSA-N
MW343.31 g/mol
LogP2.15
Rot. Bonds4

About 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide

5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide (PubChem CID 167939518) has the molecular formula C14H16F3N5O2 and a molecular weight of 343.31 g/mol. Its IUPAC name is 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide
PubChem CID167939518
Molecular FormulaC14H16F3N5O2
Molecular Weight343.31 g/mol
Exact Mass343.13
IUPAC Name5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide
SMILESO=C(Nc1cnn(CC(F)(F)F)c1)c1ncoc1C1CCNCC1
InChIInChI=1S/C14H16F3N5O2/c15-14(16,17)7-22-6-10(5-20-22)21-13(23)11-12(24-8-19-11)9-1-3-18-4-2-9/h5-6,8-9,18H,1-4,7H2,(H,21,23)
InChIKeySNZUCHYSZYDYMT-UHFFFAOYSA-N
XLogP2.15
TPSA84.98 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.31
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide (CID 167939518) is 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide is O=C(Nc1cnn(CC(F)(F)F)c1)c1ncoc1C1CCNCC1.
What is the InChIKey of 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide?
The InChIKey is SNZUCHYSZYDYMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16F3N5O2/c15-14(16,17)7-22-6-10(5-20-22)21-13(23)11-12(24-8-19-11)9-1-3-18-4-2-9/h5-6,8-9,18H,1-4,7H2,(H,21,23).
What are the key properties of 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide?
5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide has a molecular weight of 343.31 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-4-yl-N-[1-(2,2,2-trifluoroethyl)pyrazol-4-yl]-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 167939518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).