7-[3-(Benzylamino)propyl]theophylline

CN1C2=C(N(CCCNCC3=CC=CC=C3)C=N2)C(=O)N(C)C1=O

InChIKey=OVKWXBYMGXFCRZ-UHFFFAOYSA-N

InChI=1S/C17H21N5O2/c1-20-15-14(16(23)21(2)17(20)24)22(12-19-15)10-6-9-18-11-13-7-4-3-5-8-13/h3-5,7-8,12,18H,6,9-11H2,1-2H3

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Substance Class	Chemical Created by `admin` on `Tue Apr 01 19:16:36 GMT 2025` Edited by `admin` on `Tue Apr 01 19:16:36 GMT 2025`
Record UNII	G8V7CR9J8T
Record Status	`Validated (UNII)`
Record Version

Name

Type

Language

7-(3-(Benzylamino)propyl)-3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione

Preferred Name

English

7-[3-(Benzylamino)propyl]theophylline

Systematic Name

English

3,7-Dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-1H-purine-2,6-dione

Systematic Name

English

7-(N-Benzyl-3-aminopropyl)theophylline

Systematic Name

English

1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-7-[3-[(phenylmethyl)amino]propyl]-

Systematic Name

English

Code System Code Type Description

PUBCHEM

90641