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O-(2,2,5,5-tetramethyl-1-cyclopentyl)-1-amino-1-hydroxymethylcyclopropane

HCID 20165720
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC1(C)CCC(C)(C)C1OCC1(N)CC1
InChIKey
JPLAAFALEQRFLY-UHFFFAOYSA-N
Molecular formula
C13H25NO
Average molar mass
211.34 g/mol

Names & identifiers

Preferred name
O-(2,2,5,5-tetramethyl-1-cyclopentyl)-1-amino-1-hydroxymethylcyclopropane
IUPAC
1-[(2,2,5,5-tetramethylcyclopentyl)oxymethyl]cyclopropan-1-amine

Names & synonyms

SCHEMBL10798522JPLAAFALEQRFLY-UHFFFAOYSA-NO-(2,2,5,5-tetramethyl-1-cyclopentyl)-1-amino-1-hydroxymethylcyclopropane

Database identifiers

PubChem CID
20165720

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
35.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
15
Formal charge
0
Complexity
237

Related reactions

3 records
New reaction record
HRID 255468 reaction equation
HRID 255468As productuspto-grants-1987_10
HRID 683196 reaction equation
HRID 683196As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1731686 reaction equation
HRID 1731686As productuspto-grants-1986_11

Compound notes

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On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes