WNSPKWUGXRVCEQ-UHFFFAOYSA-N

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

C₂₃H₂₆F₃N₃O₂ — CID 118562605

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

IUPAC2-methyl-4-phenyl-9-[2-[4-(trifluoromethyl)-2-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one

SMILESCC1OC2(CCN(CCc3cc(C(F)(F)F)ccn3)CC2)CN(c2ccccc2)C1=O

InChIInChI=1S/C23H26F3N3O2/c1-17-21(30)29(20-5-3-2-4-6-20)16-22(31-17)9-13-28(14-10-22)12-8-19-15-18(7-11-27-19)23(24,25)26/h2-7,11,15,17H,8-10,12-14,16H2,1H3

InChIKeyWNSPKWUGXRVCEQ-UHFFFAOYSA-N

MW433.47 g/mol

LogP3.93

Rot. Bonds4

About WNSPKWUGXRVCEQ-UHFFFAOYSA-N

WNSPKWUGXRVCEQ-UHFFFAOYSA-N (PubChem CID 118562605) has the molecular formula C₂₃H₂₆F₃N₃O₂ and a molecular weight of 433.47 g/mol. Its IUPAC name is 2-methyl-4-phenyl-9-[2-[4-(trifluoromethyl)-2-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one.

Molecular Properties

Compound Name	WNSPKWUGXRVCEQ-UHFFFAOYSA-N
PubChem CID	118562605
Molecular Formula	C₂₃H₂₆F₃N₃O₂
Molecular Weight	433.47 g/mol
Exact Mass	433.20
IUPAC Name	2-methyl-4-phenyl-9-[2-[4-(trifluoromethyl)-2-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
SMILES	CC1OC2(CCN(CCc3cc(C(F)(F)F)ccn3)CC2)CN(c2ccccc2)C1=O
InChI	InChI=1S/C23H26F3N3O2/c1-17-21(30)29(20-5-3-2-4-6-20)16-22(31-17)9-13-28(14-10-22)12-8-19-15-18(7-11-27-19)23(24,25)26/h2-7,11,15,17H,8-10,12-14,16H2,1H3
InChIKey	WNSPKWUGXRVCEQ-UHFFFAOYSA-N
XLogP	3.93
TPSA	45.67 Å²
H-Bond Donors
H-Bond Acceptors	4
Rotatable Bonds	4
Heavy Atoms	31
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	433.47
LogP ≤ 5	3.93
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of WNSPKWUGXRVCEQ-UHFFFAOYSA-N (CID 118562605) is 2-methyl-4-phenyl-9-[2-[4-(trifluoromethyl)-2-pyridinyl]ethyl]-1-oxa-4,9-diazaspiro[5.5]undecan-3-one.

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

The canonical SMILES for WNSPKWUGXRVCEQ-UHFFFAOYSA-N is CC1OC2(CCN(CCc3cc(C(F)(F)F)ccn3)CC2)CN(c2ccccc2)C1=O.

What is the InChIKey of WNSPKWUGXRVCEQ-UHFFFAOYSA-N?

The InChIKey is WNSPKWUGXRVCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26F3N3O2/c1-17-21(30)29(20-5-3-2-4-6-20)16-22(31-17)9-13-28(14-10-22)12-8-19-15-18(7-11-27-19)23(24,25)26/h2-7,11,15,17H,8-10,12-14,16H2,1H3.

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

WNSPKWUGXRVCEQ-UHFFFAOYSA-N has a molecular weight of 433.47 g/mol, XLogP of 3.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for WNSPKWUGXRVCEQ-UHFFFAOYSA-N is sourced from PubChem (CID 118562605), 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 118562605 — identifiers, structure, computed properties (public domain)

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.