[(5-Ethylthiophen-2-yl)methyl](4-isopropylphenyl)amine

HCID 29282954
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
CCc1ccc(CNc2ccc(C(C)C)cc2)s1
InChIKey
DIWZKXXKOBZHAR-UHFFFAOYSA-N
Molecular formula
C16H21NS
Average molar mass
259.4 g/mol
Monoisotopic mass
259.13947085

Names & identifiers

Preferred name
[(5-Ethylthiophen-2-yl)methyl](4-isopropylphenyl)amine
IUPAC
N-[(5-ethylthiophen-2-yl)methyl]-4-propan-2-ylaniline

Names & synonyms

SCHEMBL1844811DIWZKXXKOBZHAR-UHFFFAOYSA-N[(5-ethylthiophen-2-yl)methyl](4-isopropylphenyl)amine

Database identifiers

PubChem CID
29282954

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
40.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
5
Heavy atoms
18

Related reactions

9 records
New reaction record

Compound notes

Loading…