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methyl N-(1,2,3,4,4a,9a-hexahydro-9H-fluoren-9-yl)glycine

HCID 70360266
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(CC(=O)O)C1c2ccccc2C2CCCCC21
InChIKey
OYWKLESLTFCQNK-UHFFFAOYSA-N
Molecular formula
C16H21NO2
Average molar mass
259.34 g/mol

Names & identifiers

Preferred name
methyl N-(1,2,3,4,4a,9a-hexahydro-9H-fluoren-9-yl)glycine
IUPAC
2-[2,3,4,4a,9,9a-hexahydro-1H-fluoren-9-yl(methyl)amino]acetic acid

Names & synonyms

SCHEMBL10408028OYWKLESLTFCQNK-UHFFFAOYSA-Nmethyl N-(1,2,3,4,4a,9a-hexahydro-9H-fluoren-9-yl) glycinemethyl N-(1,2,3,4,4a,9a-hexahydro-9H-fluoren-9-yl)glycine

Database identifiers

PubChem CID
70360266

Properties

Computed structural properties

XLogP
0.9
Topological polar surface area
40.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Formal charge
0
Complexity
344

Related reactions

5 records
New reaction record
HRID 1650993 reaction equation
HRID 1650993As productuspto-grants-1990_05
HRID 1650994 reaction equation
HRID 1650994As reactantuspto-grants-1990_05
HRID 1762040 reaction equation
HRID 1762040As productuspto-grants-1989_05
HRID 1762041 reaction equation
HRID 1762041As reactantuspto-grants-1989_05
HRID 2160089 reaction equation
HRID 2160089As productTraining data from https://doi.org/10.1039/C8SC04228D (4/10)

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes