2-(3,5-Dimethoxyphenyl)-2-isopropyl-5-methylaminovaleronitrile

HCID 22158477

Basic information

Standard SMILES
CNCCCC(C#N)(c1cc(OC)cc(OC)c1)C(C)C
InChIKey
DFLRQCFHHLPXHJ-UHFFFAOYSA-N
Molecular formula
C17H26N2O2
Average molar mass
290.4 g/mol

Names & identifiers

Preferred name
2-(3,5-Dimethoxyphenyl)-2-isopropyl-5-methylaminovaleronitrile
IUPAC
2-(3,5-dimethoxyphenyl)-5-(methylamino)-2-propan-2-ylpentanenitrile

Names & synonyms

SCHEMBL7272299DFLRQCFHHLPXHJ-UHFFFAOYSA-N2-(3,5-dimethoxyphenyl)-2-isopropyl-5-methylaminovaleronitrile5-methylamino-2-(3,5-dimethoxyphenyl)-2-isopropylvaleronitrile

Database identifiers

PubChem CID
22158477

Properties

Computed structural properties

XLogP
3
Topological polar surface area
54.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
8
Heavy atoms
21

Related reactions

4 records

Compound notes

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