N-(3-amino-5-tert-butyl-2-methoxy-benzyl)-N,N',N'-trimethyl-ethane-1,2-diamine

HCID 21097366
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COc1c(N)cc(C(C)(C)C)cc1CN(C)CCN(C)C
InChIKey
GXYNBVBCJMXTON-UHFFFAOYSA-N
Molecular formula
C17H31N3O
Average molar mass
293.4 g/mol

Names & identifiers

Preferred name
N-(3-amino-5-tert-butyl-2-methoxy-benzyl)-N,N',N'-trimethyl-ethane-1,2-diamine
IUPAC
N'-[(3-amino-5-tert-butyl-2-methoxyphenyl)methyl]-N,N,N'-trimethylethane-1,2-diamine

Names & synonyms

SCHEMBL1404655GXYNBVBCJMXTON-UHFFFAOYSA-NN-(3-amino-5-tert-butyl-2-methoxy-benzyl)-N,N',N'-trimethyl-ethane-1,2-diamine

Database identifiers

PubChem CID
21097366

Properties

Computed structural properties

XLogP
2.8
Topological polar surface area
41.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
7
Heavy atoms
21

Related reactions

3 records
New reaction record

Compound notes

Loading…