Nemonoxacin

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

C₂₀H₂₅N₃O₄ — CID 11993740

💊View drug profile → nemonoxacin

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

IUPAC7-[(3S,5S)-3-amino-5-methylpiperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid

SMILESCOc1c(N2C[C@@H](C)C[C@H](N)C2)ccc2c(=O)c(C(=O)O)cn(C3CC3)c12

InChIInChI=1S/C20H25N3O4/c1-11-7-12(21)9-22(8-11)16-6-5-14-17(19(16)27-2)23(13-3-4-13)10-15(18(14)24)20(25)26/h5-6,10-13H,3-4,7-9,21H2,1-2H3,(H,25,26)/t11-,12-/m0/s1

InChIKeyAVPQPGFLVZTJOR-RYUDHWBXSA-N

MW371.44 g/mol

LogP2.22

Rot. Bonds4

About Nemonoxacin

Nemonoxacin (PubChem CID 11993740) has the molecular formula C₂₀H₂₅N₃O₄ and a molecular weight of 371.44 g/mol. Its IUPAC name is 7-[(3S,5S)-3-amino-5-methylpiperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid.

Molecular Properties

Compound Name	Nemonoxacin
PubChem CID	11993740
Molecular Formula	C₂₀H₂₅N₃O₄
Molecular Weight	371.44 g/mol
Exact Mass	371.18
IUPAC Name	7-[(3S,5S)-3-amino-5-methylpiperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid
SMILES	COc1c(N2C[C@@H](C)C[C@H](N)C2)ccc2c(=O)c(C(=O)O)cn(C3CC3)c12
InChI	InChI=1S/C20H25N3O4/c1-11-7-12(21)9-22(8-11)16-6-5-14-17(19(16)27-2)23(13-3-4-13)10-15(18(14)24)20(25)26/h5-6,10-13H,3-4,7-9,21H2,1-2H3,(H,25,26)/t11-,12-/m0/s1
InChIKey	AVPQPGFLVZTJOR-RYUDHWBXSA-N
XLogP	2.22
TPSA	97.79 Å²
H-Bond Donors	2
H-Bond Acceptors	6
Rotatable Bonds	4
Heavy Atoms	27
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	371.44
LogP ≤ 5	2.22
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	6

Related Compounds

Frequently Asked Questions

What is the IUPAC name of Nemonoxacin?

The IUPAC name of Nemonoxacin (CID 11993740) is 7-[(3S,5S)-3-amino-5-methylpiperidin-1-yl]-1-cyclopropyl-8-methoxy-4-oxoquinoline-3-carboxylic acid.

What is the SMILES notation for Nemonoxacin?

The canonical SMILES for Nemonoxacin is COc1c(N2C[C@@H](C)C[C@H](N)C2)ccc2c(=O)c(C(=O)O)cn(C3CC3)c12.

What is the InChIKey of Nemonoxacin?

The InChIKey is AVPQPGFLVZTJOR-RYUDHWBXSA-N. The full InChI is InChI=1S/C20H25N3O4/c1-11-7-12(21)9-22(8-11)16-6-5-14-17(19(16)27-2)23(13-3-4-13)10-15(18(14)24)20(25)26/h5-6,10-13H,3-4,7-9,21H2,1-2H3,(H,25,26)/t11-,12-/m0/s1.

What are the key properties of Nemonoxacin?

Nemonoxacin has a molecular weight of 371.44 g/mol, XLogP of 2.22, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for Nemonoxacin is sourced from PubChem (CID 11993740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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

Sources

PubChem CID 11993740 — identifiers, structure, computed properties (public domain)
DrugCentral drug card 5079 — approved-drug record (CC BY-SA 4.0)

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