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1-Cyclopropyl-6-fluoro-1,4-dihydro-7-(3'-acetamido-5'-methylpvrrolidin-1-yl)-4-oxo-quinoline-3-carboxylic acid

HCID 10134799
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)NC1CC(C)N(c2cc3c(cc2F)c(=O)c(C(=O)O)cn3C2CC2)C1
InChIKey
WZUDGRCJZNLGKQ-UHFFFAOYSA-N
Molecular formula
C20H22FN3O4
Average molar mass
387.4 g/mol

Names & identifiers

Preferred name
1-Cyclopropyl-6-fluoro-1,4-dihydro-7-(3'-acetamido-5'-methylpvrrolidin-1-yl)-4-oxo-quinoline-3-carboxylic acid
IUPAC
7-(4-acetamido-2-methylpyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid

Names & synonyms

WZUDGRCJZNLGKQ-UHFFFAOYSA-N1-Cyclopropyl-6-fluoro-1,4-dihydro-7- (3'-acetamido-5'-methylpvrrolidin-1-yl)-4-oxo-quinoline-3-carboxylic acid1-Cyclopropyl-6-fluoro-1,4-dihydro-7-(3'-acetamido-5'-methylpyrrolidin-1-yl)-4-oxo-quinoline-3-carboxylic acid

Database identifiers

PubChem CID
10134799

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
90 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
4
Heavy atoms
28
Formal charge
0
Complexity
722

Related reactions

2 records
New reaction record
HRID 11290 reaction equation
HRID 11290As productuspto-grants-2006_08
HRID 932443 reaction equation
HRID 932443As productValidation data from https://doi.org/10.1039/C8SC04228D

Compound notes

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