SIZBLFUPLWZTQX-UHFFFAOYSA-N

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

C₁₉H₁₅F₃N₆O — CID 122510968

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

IUPAC6-[3-(2,2-difluoropropyl)-5-(4-fluorophenyl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carboxamide

SMILESCC(F)(F)Cn1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2n1

InChIInChI=1S/C19H15F3N6O/c1-19(21,22)9-27-10-25-16(11-2-4-12(20)5-3-11)17(27)13-6-7-15-24-8-14(18(23)29)28(15)26-13/h2-8,10H,9H2,1H3,(H2,23,29)

InChIKeySIZBLFUPLWZTQX-UHFFFAOYSA-N

MW400.36 g/mol

LogP3.15

Rot. Bonds5

About SIZBLFUPLWZTQX-UHFFFAOYSA-N

SIZBLFUPLWZTQX-UHFFFAOYSA-N (PubChem CID 122510968) has the molecular formula C₁₉H₁₅F₃N₆O and a molecular weight of 400.36 g/mol. Its IUPAC name is 6-[3-(2,2-difluoropropyl)-5-(4-fluorophenyl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carboxamide.

Molecular Properties

Compound Name	SIZBLFUPLWZTQX-UHFFFAOYSA-N
PubChem CID	122510968
Molecular Formula	C₁₉H₁₅F₃N₆O
Molecular Weight	400.36 g/mol
Exact Mass	400.13
IUPAC Name	6-[3-(2,2-difluoropropyl)-5-(4-fluorophenyl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carboxamide
SMILES	CC(F)(F)Cn1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2n1
InChI	InChI=1S/C19H15F3N6O/c1-19(21,22)9-27-10-25-16(11-2-4-12(20)5-3-11)17(27)13-6-7-15-24-8-14(18(23)29)28(15)26-13/h2-8,10H,9H2,1H3,(H2,23,29)
InChIKey	SIZBLFUPLWZTQX-UHFFFAOYSA-N
XLogP	3.15
TPSA	91.10 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	5
Heavy Atoms	29
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	400.36
LogP ≤ 5	3.15
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

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

The IUPAC name of SIZBLFUPLWZTQX-UHFFFAOYSA-N (CID 122510968) is 6-[3-(2,2-difluoropropyl)-5-(4-fluorophenyl)imidazol-4-yl]imidazo[1,2-b]pyridazine-3-carboxamide.

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

The canonical SMILES for SIZBLFUPLWZTQX-UHFFFAOYSA-N is CC(F)(F)Cn1cnc(-c2ccc(F)cc2)c1-c1ccc2ncc(C(N)=O)n2n1.

What is the InChIKey of SIZBLFUPLWZTQX-UHFFFAOYSA-N?

The InChIKey is SIZBLFUPLWZTQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F3N6O/c1-19(21,22)9-27-10-25-16(11-2-4-12(20)5-3-11)17(27)13-6-7-15-24-8-14(18(23)29)28(15)26-13/h2-8,10H,9H2,1H3,(H2,23,29).

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

SIZBLFUPLWZTQX-UHFFFAOYSA-N has a molecular weight of 400.36 g/mol, XLogP of 3.15, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for SIZBLFUPLWZTQX-UHFFFAOYSA-N is sourced from PubChem (CID 122510968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 122510968 — identifiers, structure, computed properties (public domain)

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