2-(Propylamino)-4-(3-diethylamino-1-propoxy)nitrobenzene

HCID 22014714
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Basic information

Standard SMILES
CCCNc1cc(OCCCN(CC)CC)ccc1[N+](=O)[O-]
InChIKey
IOOFKYVYBDXCHS-UHFFFAOYSA-N
Molecular formula
C16H27N3O3
Average molar mass
309.4 g/mol

Names & identifiers

Preferred name
2-(Propylamino)-4-(3-diethylamino-1-propoxy)nitrobenzene
IUPAC
5-[3-(diethylamino)propoxy]-2-nitro-N-propylaniline

Names & synonyms

SCHEMBL4981482IOOFKYVYBDXCHS-UHFFFAOYSA-N2-(propylamino)-4-(3-diethylamino-1-propoxy)nitrobenzene

Database identifiers

PubChem CID
22014714

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
70.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
10
Heavy atoms
22

Related reactions

3 records
New reaction record

Compound notes

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