Quixin

Name: Quixin — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₁₈H₂₀FN₃O₄ — CID 6956357

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

IUPAC(2S)-7-fluoro-2-methyl-6-(4-methylpiperazin-4-ium-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate

SMILESC[C@H]1COc2c(N3CC[NH+](C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23

InChIInChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1

InChIKeyGSDSWSVVBLHKDQ-JTQLQIEISA-N

MW361.37 g/mol

LogP-1.21

Rot. Bonds2

About Quixin

Quixin (PubChem CID 6956357) has the molecular formula C₁₈H₂₀FN₃O₄ and a molecular weight of 361.37 g/mol. Its IUPAC name is (2S)-7-fluoro-2-methyl-6-(4-methylpiperazin-4-ium-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate.

Molecular Properties

Compound Name	Quixin
PubChem CID	6956357
Molecular Formula	C₁₈H₂₀FN₃O₄
Molecular Weight	361.37 g/mol
Exact Mass	361.14
IUPAC Name	(2S)-7-fluoro-2-methyl-6-(4-methylpiperazin-4-ium-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate
SMILES	C[C@H]1COc2c(N3CC[NH+](C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23
InChI	InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1
InChIKey	GSDSWSVVBLHKDQ-JTQLQIEISA-N
XLogP	-1.21
TPSA	79.04 Å²
H-Bond Donors	1
H-Bond Acceptors	6
Rotatable Bonds	2
Heavy Atoms	26
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	361.37
LogP ≤ 5	-1.21
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Related Compounds

Frequently Asked Questions

What is the IUPAC name of Quixin?

The IUPAC name of Quixin (CID 6956357) is (2S)-7-fluoro-2-methyl-6-(4-methylpiperazin-4-ium-1-yl)-10-oxo-4-oxa-1-azatricyclo[7.3.1.05,13]trideca-5(13),6,8,11-tetraene-11-carboxylate.

What is the SMILES notation for Quixin?

The canonical SMILES for Quixin is C[C@H]1COc2c(N3CC[NH+](C)CC3)c(F)cc3c(=O)c(C(=O)[O-])cn1c23.

What is the InChIKey of Quixin?

The InChIKey is GSDSWSVVBLHKDQ-JTQLQIEISA-N. The full InChI is InChI=1S/C18H20FN3O4/c1-10-9-26-17-14-11(16(23)12(18(24)25)8-22(10)14)7-13(19)15(17)21-5-3-20(2)4-6-21/h7-8,10H,3-6,9H2,1-2H3,(H,24,25)/t10-/m0/s1.

What are the key properties of Quixin?

Quixin has a molecular weight of 361.37 g/mol, XLogP of -1.21, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Quixin is sourced from PubChem (CID 6956357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules: Q · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

PubChem CID 6956357 — identifiers, structure, computed properties (public domain)
DrugCentral drug card 1569 — approved-drug record (CC BY-SA 4.0)

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