UJLFOGHTSGPFJZ-UHFFFAOYSA-N

Name: UJLFOGHTSGPFJZ-UHFFFAOYSA-N — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₂₁H₁₃F₆N₅O₂ — CID 152922889

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPACN-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide

SMILESO=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccncc2)on1

InChIInChI=1S/C21H13F6N5O2/c22-20(23,24)14-2-1-13(16(7-14)21(25,26)27)10-32-11-15(9-29-32)30-19(33)17-8-18(34-31-17)12-3-5-28-6-4-12/h1-9,11H,10H2,(H,30,33)

InChIKeyUJLFOGHTSGPFJZ-UHFFFAOYSA-N

MW481.36 g/mol

LogP5.27

Rot. Bonds5

About UJLFOGHTSGPFJZ-UHFFFAOYSA-N

UJLFOGHTSGPFJZ-UHFFFAOYSA-N (PubChem CID 152922889) has the molecular formula C₂₁H₁₃F₆N₅O₂ and a molecular weight of 481.36 g/mol. Its IUPAC name is N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide.

Molecular Properties

Compound Name	UJLFOGHTSGPFJZ-UHFFFAOYSA-N
PubChem CID	152922889
Molecular Formula	C₂₁H₁₃F₆N₅O₂
Molecular Weight	481.36 g/mol
Exact Mass	481.10
IUPAC Name	N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide
SMILES	O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccncc2)on1
InChI	InChI=1S/C21H13F6N5O2/c22-20(23,24)14-2-1-13(16(7-14)21(25,26)27)10-32-11-15(9-29-32)30-19(33)17-8-18(34-31-17)12-3-5-28-6-4-12/h1-9,11H,10H2,(H,30,33)
InChIKey	UJLFOGHTSGPFJZ-UHFFFAOYSA-N
XLogP	5.27
TPSA	85.84 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	5
Heavy Atoms	34
Complexity	—

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	481.36
LogP ≤ 5	5.27
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of UJLFOGHTSGPFJZ-UHFFFAOYSA-N?

The IUPAC name of UJLFOGHTSGPFJZ-UHFFFAOYSA-N (CID 152922889) is N-[1-[[2,4-bis(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-5-pyridin-4-yl-1,2-oxazole-3-carboxamide.

What is the SMILES notation for UJLFOGHTSGPFJZ-UHFFFAOYSA-N?

The canonical SMILES for UJLFOGHTSGPFJZ-UHFFFAOYSA-N is O=C(Nc1cnn(Cc2ccc(C(F)(F)F)cc2C(F)(F)F)c1)c1cc(-c2ccncc2)on1.

What is the InChIKey of UJLFOGHTSGPFJZ-UHFFFAOYSA-N?

The InChIKey is UJLFOGHTSGPFJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H13F6N5O2/c22-20(23,24)14-2-1-13(16(7-14)21(25,26)27)10-32-11-15(9-29-32)30-19(33)17-8-18(34-31-17)12-3-5-28-6-4-12/h1-9,11H,10H2,(H,30,33).

What are the key properties of UJLFOGHTSGPFJZ-UHFFFAOYSA-N?

UJLFOGHTSGPFJZ-UHFFFAOYSA-N has a molecular weight of 481.36 g/mol, XLogP of 5.27, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for UJLFOGHTSGPFJZ-UHFFFAOYSA-N is sourced from PubChem (CID 152922889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules A–Z · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 152922889 — identifiers, structure, computed properties (public domain)

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