SJWCAZQFRLTBAH-UHFFFAOYSA-N

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

C₂₂H₂₃F₃N₄O — CID 10525956

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

IUPAC4-[3-[5-pyridin-4-yl-4-[3-(trifluoromethyl)phenyl]imidazol-1-yl]propyl]morpholine

SMILESFC(F)(F)c1cccc(-c2ncn(CCCN3CCOCC3)c2-c2ccncc2)c1

InChIInChI=1S/C22H23F3N4O/c23-22(24,25)19-4-1-3-18(15-19)20-21(17-5-7-26-8-6-17)29(16-27-20)10-2-9-28-11-13-30-14-12-28/h1,3-8,15-16H,2,9-14H2

InChIKeySJWCAZQFRLTBAH-UHFFFAOYSA-N

MW416.45 g/mol

LogP4.35

Rot. Bonds6

About SJWCAZQFRLTBAH-UHFFFAOYSA-N

SJWCAZQFRLTBAH-UHFFFAOYSA-N (PubChem CID 10525956) has the molecular formula C₂₂H₂₃F₃N₄O and a molecular weight of 416.45 g/mol. Its IUPAC name is 4-[3-[5-pyridin-4-yl-4-[3-(trifluoromethyl)phenyl]imidazol-1-yl]propyl]morpholine.

Molecular Properties

Compound Name	SJWCAZQFRLTBAH-UHFFFAOYSA-N
PubChem CID	10525956
Molecular Formula	C₂₂H₂₃F₃N₄O
Molecular Weight	416.45 g/mol
Exact Mass	416.18
IUPAC Name	4-[3-[5-pyridin-4-yl-4-[3-(trifluoromethyl)phenyl]imidazol-1-yl]propyl]morpholine
SMILES	FC(F)(F)c1cccc(-c2ncn(CCCN3CCOCC3)c2-c2ccncc2)c1
InChI	InChI=1S/C22H23F3N4O/c23-22(24,25)19-4-1-3-18(15-19)20-21(17-5-7-26-8-6-17)29(16-27-20)10-2-9-28-11-13-30-14-12-28/h1,3-8,15-16H,2,9-14H2
InChIKey	SJWCAZQFRLTBAH-UHFFFAOYSA-N
XLogP	4.35
TPSA	43.18 Å²
H-Bond Donors
H-Bond Acceptors	5
Rotatable Bonds	6
Heavy Atoms	30
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	416.45
LogP ≤ 5	4.35
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of SJWCAZQFRLTBAH-UHFFFAOYSA-N (CID 10525956) is 4-[3-[5-pyridin-4-yl-4-[3-(trifluoromethyl)phenyl]imidazol-1-yl]propyl]morpholine.

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

The canonical SMILES for SJWCAZQFRLTBAH-UHFFFAOYSA-N is FC(F)(F)c1cccc(-c2ncn(CCCN3CCOCC3)c2-c2ccncc2)c1.

What is the InChIKey of SJWCAZQFRLTBAH-UHFFFAOYSA-N?

The InChIKey is SJWCAZQFRLTBAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23F3N4O/c23-22(24,25)19-4-1-3-18(15-19)20-21(17-5-7-26-8-6-17)29(16-27-20)10-2-9-28-11-13-30-14-12-28/h1,3-8,15-16H,2,9-14H2.

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

SJWCAZQFRLTBAH-UHFFFAOYSA-N has a molecular weight of 416.45 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for SJWCAZQFRLTBAH-UHFFFAOYSA-N is sourced from PubChem (CID 10525956), 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 10525956 — identifiers, structure, computed properties (public domain)

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