DKOUKLAZGLYFDX-UHFFFAOYSA-N

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

C₁₈H₁₉F₃N₆O₂ — CID 146381605

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

IUPAC3-methoxy-N-[6-(3-propan-2-ylimidazol-4-yl)-2-pyridinyl]-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide

SMILESCOc1nn(CC(F)(F)F)cc1C(=O)Nc1cccc(-c2cncn2C(C)C)n1

InChIInChI=1S/C18H19F3N6O2/c1-11(2)27-10-22-7-14(27)13-5-4-6-15(23-13)24-16(28)12-8-26(9-18(19,20)21)25-17(12)29-3/h4-8,10-11H,9H2,1-3H3,(H,23,24,28)

InChIKeyDKOUKLAZGLYFDX-UHFFFAOYSA-N

MW408.38 g/mol

LogP3.55

Rot. Bonds6

About DKOUKLAZGLYFDX-UHFFFAOYSA-N

DKOUKLAZGLYFDX-UHFFFAOYSA-N (PubChem CID 146381605) has the molecular formula C₁₈H₁₉F₃N₆O₂ and a molecular weight of 408.38 g/mol. Its IUPAC name is 3-methoxy-N-[6-(3-propan-2-ylimidazol-4-yl)-2-pyridinyl]-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name	DKOUKLAZGLYFDX-UHFFFAOYSA-N
PubChem CID	146381605
Molecular Formula	C₁₈H₁₉F₃N₆O₂
Molecular Weight	408.38 g/mol
Exact Mass	408.15
IUPAC Name	3-methoxy-N-[6-(3-propan-2-ylimidazol-4-yl)-2-pyridinyl]-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide
SMILES	COc1nn(CC(F)(F)F)cc1C(=O)Nc1cccc(-c2cncn2C(C)C)n1
InChI	InChI=1S/C18H19F3N6O2/c1-11(2)27-10-22-7-14(27)13-5-4-6-15(23-13)24-16(28)12-8-26(9-18(19,20)21)25-17(12)29-3/h4-8,10-11H,9H2,1-3H3,(H,23,24,28)
InChIKey	DKOUKLAZGLYFDX-UHFFFAOYSA-N
XLogP	3.55
TPSA	86.86 Å²
H-Bond Donors	1
H-Bond Acceptors	7
Rotatable Bonds	6
Heavy Atoms	29
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	408.38
LogP ≤ 5	3.55
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

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

The IUPAC name of DKOUKLAZGLYFDX-UHFFFAOYSA-N (CID 146381605) is 3-methoxy-N-[6-(3-propan-2-ylimidazol-4-yl)-2-pyridinyl]-1-(2,2,2-trifluoroethyl)pyrazole-4-carboxamide.

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

The canonical SMILES for DKOUKLAZGLYFDX-UHFFFAOYSA-N is COc1nn(CC(F)(F)F)cc1C(=O)Nc1cccc(-c2cncn2C(C)C)n1.

What is the InChIKey of DKOUKLAZGLYFDX-UHFFFAOYSA-N?

The InChIKey is DKOUKLAZGLYFDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19F3N6O2/c1-11(2)27-10-22-7-14(27)13-5-4-6-15(23-13)24-16(28)12-8-26(9-18(19,20)21)25-17(12)29-3/h4-8,10-11H,9H2,1-3H3,(H,23,24,28).

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

DKOUKLAZGLYFDX-UHFFFAOYSA-N has a molecular weight of 408.38 g/mol, XLogP of 3.55, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for DKOUKLAZGLYFDX-UHFFFAOYSA-N is sourced from PubChem (CID 146381605), 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 146381605 — identifiers, structure, computed properties (public domain)

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