OHEGTVPMIBZYEC-SJKOYZFVSA-N

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

C₂₀H₁₈F₃N₇O₂ — CID 139365229

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

IUPAC(2R,6S)-2-methyl-6-(1H-pyrazol-4-yl)-4-[4-[6-(trifluoromethoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]morpholine

SMILESC[C@@H]1CN(c2nccc(-c3cnc4ccc(OC(F)(F)F)cn34)n2)C[C@H](c2cn[nH]c2)O1

InChIInChI=1S/C20H18F3N7O2/c1-12-9-29(11-17(31-12)13-6-26-27-7-13)19-24-5-4-15(28-19)16-8-25-18-3-2-14(10-30(16)18)32-20(21,22)23/h2-8,10,12,17H,9,11H2,1H3,(H,26,27)/t12-,17-/m1/s1

InChIKeyOHEGTVPMIBZYEC-SJKOYZFVSA-N

MW445.41 g/mol

LogP3.38

Rot. Bonds4

About OHEGTVPMIBZYEC-SJKOYZFVSA-N

OHEGTVPMIBZYEC-SJKOYZFVSA-N (PubChem CID 139365229) has the molecular formula C₂₀H₁₈F₃N₇O₂ and a molecular weight of 445.41 g/mol. Its IUPAC name is (2R,6S)-2-methyl-6-(1H-pyrazol-4-yl)-4-[4-[6-(trifluoromethoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]morpholine.

Molecular Properties

Compound Name	OHEGTVPMIBZYEC-SJKOYZFVSA-N
PubChem CID	139365229
Molecular Formula	C₂₀H₁₈F₃N₇O₂
Molecular Weight	445.41 g/mol
Exact Mass	445.15
IUPAC Name	(2R,6S)-2-methyl-6-(1H-pyrazol-4-yl)-4-[4-[6-(trifluoromethoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]morpholine
SMILES	C[C@@H]1CN(c2nccc(-c3cnc4ccc(OC(F)(F)F)cn34)n2)C[C@H](c2cn[nH]c2)O1
InChI	InChI=1S/C20H18F3N7O2/c1-12-9-29(11-17(31-12)13-6-26-27-7-13)19-24-5-4-15(28-19)16-8-25-18-3-2-14(10-30(16)18)32-20(21,22)23/h2-8,10,12,17H,9,11H2,1H3,(H,26,27)/t12-,17-/m1/s1
InChIKey	OHEGTVPMIBZYEC-SJKOYZFVSA-N
XLogP	3.38
TPSA	93.46 Å²
H-Bond Donors	1
H-Bond Acceptors	8
Rotatable Bonds	4
Heavy Atoms	32
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	445.41
LogP ≤ 5	3.38
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	8

Frequently Asked Questions

What is the IUPAC name of OHEGTVPMIBZYEC-SJKOYZFVSA-N?

The IUPAC name of OHEGTVPMIBZYEC-SJKOYZFVSA-N (CID 139365229) is (2R,6S)-2-methyl-6-(1H-pyrazol-4-yl)-4-[4-[6-(trifluoromethoxy)imidazo[1,2-a]pyridin-3-yl]pyrimidin-2-yl]morpholine.

What is the SMILES notation for OHEGTVPMIBZYEC-SJKOYZFVSA-N?

The canonical SMILES for OHEGTVPMIBZYEC-SJKOYZFVSA-N is C[C@@H]1CN(c2nccc(-c3cnc4ccc(OC(F)(F)F)cn34)n2)C[C@H](c2cn[nH]c2)O1.

What is the InChIKey of OHEGTVPMIBZYEC-SJKOYZFVSA-N?

The InChIKey is OHEGTVPMIBZYEC-SJKOYZFVSA-N. The full InChI is InChI=1S/C20H18F3N7O2/c1-12-9-29(11-17(31-12)13-6-26-27-7-13)19-24-5-4-15(28-19)16-8-25-18-3-2-14(10-30(16)18)32-20(21,22)23/h2-8,10,12,17H,9,11H2,1H3,(H,26,27)/t12-,17-/m1/s1.

What are the key properties of OHEGTVPMIBZYEC-SJKOYZFVSA-N?

OHEGTVPMIBZYEC-SJKOYZFVSA-N has a molecular weight of 445.41 g/mol, XLogP of 3.38, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for OHEGTVPMIBZYEC-SJKOYZFVSA-N is sourced from PubChem (CID 139365229), 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 139365229 — 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.