MWWVHJVRVXPDBZ-UHFFFAOYSA-N

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

C₂₀H₁₆F₃N₅O₂ — CID 118335588

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

IUPAC3-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,2-oxazole-4-carboxamide

SMILESCc1ccc2c(NC(=O)c3conc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1

InChIInChI=1S/C20H16F3N5O2/c1-11-3-8-15-17(25-19(29)16-10-30-27-12(16)2)26-28(18(15)24-11)9-13-4-6-14(7-5-13)20(21,22)23/h3-8,10H,9H2,1-2H3,(H,25,26,29)

InChIKeyMWWVHJVRVXPDBZ-UHFFFAOYSA-N

MW415.38 g/mol

LogP4.36

Rot. Bonds4

About MWWVHJVRVXPDBZ-UHFFFAOYSA-N

MWWVHJVRVXPDBZ-UHFFFAOYSA-N (PubChem CID 118335588) has the molecular formula C₂₀H₁₆F₃N₅O₂ and a molecular weight of 415.38 g/mol. Its IUPAC name is 3-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name	MWWVHJVRVXPDBZ-UHFFFAOYSA-N
PubChem CID	118335588
Molecular Formula	C₂₀H₁₆F₃N₅O₂
Molecular Weight	415.38 g/mol
Exact Mass	415.13
IUPAC Name	3-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,2-oxazole-4-carboxamide
SMILES	Cc1ccc2c(NC(=O)c3conc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1
InChI	InChI=1S/C20H16F3N5O2/c1-11-3-8-15-17(25-19(29)16-10-30-27-12(16)2)26-28(18(15)24-11)9-13-4-6-14(7-5-13)20(21,22)23/h3-8,10H,9H2,1-2H3,(H,25,26,29)
InChIKey	MWWVHJVRVXPDBZ-UHFFFAOYSA-N
XLogP	4.36
TPSA	85.84 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	4
Heavy Atoms	30
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	415.38
LogP ≤ 5	4.36
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

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

The IUPAC name of MWWVHJVRVXPDBZ-UHFFFAOYSA-N (CID 118335588) is 3-methyl-N-[6-methyl-1-[[4-(trifluoromethyl)phenyl]methyl]pyrazolo[5,4-b]pyridin-3-yl]-1,2-oxazole-4-carboxamide.

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

The canonical SMILES for MWWVHJVRVXPDBZ-UHFFFAOYSA-N is Cc1ccc2c(NC(=O)c3conc3C)nn(Cc3ccc(C(F)(F)F)cc3)c2n1.

What is the InChIKey of MWWVHJVRVXPDBZ-UHFFFAOYSA-N?

The InChIKey is MWWVHJVRVXPDBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16F3N5O2/c1-11-3-8-15-17(25-19(29)16-10-30-27-12(16)2)26-28(18(15)24-11)9-13-4-6-14(7-5-13)20(21,22)23/h3-8,10H,9H2,1-2H3,(H,25,26,29).

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

MWWVHJVRVXPDBZ-UHFFFAOYSA-N has a molecular weight of 415.38 g/mol, XLogP of 4.36, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for MWWVHJVRVXPDBZ-UHFFFAOYSA-N is sourced from PubChem (CID 118335588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 118335588 — identifiers, structure, computed properties (public domain)

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