LZJJQGONRPKHMU-UHFFFAOYSA-N

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

C₁₉H₂₃F₃N₄O₂ — CID 121427025

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

IUPACN-[2-[(4,6-dimethylpyrimidin-2-yl)-methylamino]ethyl]-N-ethyl-2-(trifluoromethoxy)benzamide

SMILESCCN(CCN(C)c1nc(C)cc(C)n1)C(=O)c1ccccc1OC(F)(F)F

InChIInChI=1S/C19H23F3N4O2/c1-5-26(11-10-25(4)18-23-13(2)12-14(3)24-18)17(27)15-8-6-7-9-16(15)28-19(20,21)22/h6-9,12H,5,10-11H2,1-4H3

InChIKeyLZJJQGONRPKHMU-UHFFFAOYSA-N

MW396.41 g/mol

LogP3.59

Rot. Bonds7

About LZJJQGONRPKHMU-UHFFFAOYSA-N

LZJJQGONRPKHMU-UHFFFAOYSA-N (PubChem CID 121427025) has the molecular formula C₁₉H₂₃F₃N₄O₂ and a molecular weight of 396.41 g/mol. Its IUPAC name is N-[2-[(4,6-dimethylpyrimidin-2-yl)-methylamino]ethyl]-N-ethyl-2-(trifluoromethoxy)benzamide.

Molecular Properties

Compound Name	LZJJQGONRPKHMU-UHFFFAOYSA-N
PubChem CID	121427025
Molecular Formula	C₁₉H₂₃F₃N₄O₂
Molecular Weight	396.41 g/mol
Exact Mass	396.18
IUPAC Name	N-[2-[(4,6-dimethylpyrimidin-2-yl)-methylamino]ethyl]-N-ethyl-2-(trifluoromethoxy)benzamide
SMILES	CCN(CCN(C)c1nc(C)cc(C)n1)C(=O)c1ccccc1OC(F)(F)F
InChI	InChI=1S/C19H23F3N4O2/c1-5-26(11-10-25(4)18-23-13(2)12-14(3)24-18)17(27)15-8-6-7-9-16(15)28-19(20,21)22/h6-9,12H,5,10-11H2,1-4H3
InChIKey	LZJJQGONRPKHMU-UHFFFAOYSA-N
XLogP	3.59
TPSA	58.56 Å²
H-Bond Donors
H-Bond Acceptors	5
Rotatable Bonds	7
Heavy Atoms	28
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	396.41
LogP ≤ 5	3.59
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

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

The IUPAC name of LZJJQGONRPKHMU-UHFFFAOYSA-N (CID 121427025) is N-[2-[(4,6-dimethylpyrimidin-2-yl)-methylamino]ethyl]-N-ethyl-2-(trifluoromethoxy)benzamide.

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

The canonical SMILES for LZJJQGONRPKHMU-UHFFFAOYSA-N is CCN(CCN(C)c1nc(C)cc(C)n1)C(=O)c1ccccc1OC(F)(F)F.

What is the InChIKey of LZJJQGONRPKHMU-UHFFFAOYSA-N?

The InChIKey is LZJJQGONRPKHMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23F3N4O2/c1-5-26(11-10-25(4)18-23-13(2)12-14(3)24-18)17(27)15-8-6-7-9-16(15)28-19(20,21)22/h6-9,12H,5,10-11H2,1-4H3.

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

LZJJQGONRPKHMU-UHFFFAOYSA-N has a molecular weight of 396.41 g/mol, XLogP of 3.59, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for LZJJQGONRPKHMU-UHFFFAOYSA-N is sourced from PubChem (CID 121427025), 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 121427025 — identifiers, structure, computed properties (public domain)

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