N,N-dipropyl-7H-purin-6-amine

C11H17N5 — CID 756688

IUPACN,N-dipropyl-7H-purin-6-amine
SMILESCCCN(CCC)c1ncnc2nc[nH]c12
InChIInChI=1S/C11H17N5/c1-3-5-16(6-4-2)11-9-10(13-7-12-9)14-8-15-11/h7-8H,3-6H2,1-2H3,(H,12,13,14,15)
InChIKeyZUASHJRECBALLE-UHFFFAOYSA-N
MW219.29 g/mol
LogP1.98
Rot. Bonds5

About N,N-dipropyl-7H-purin-6-amine

N,N-dipropyl-7H-purin-6-amine (PubChem CID 756688) has the molecular formula C11H17N5 and a molecular weight of 219.29 g/mol. Its IUPAC name is N,N-dipropyl-7H-purin-6-amine.

Molecular Properties

Compound NameN,N-dipropyl-7H-purin-6-amine
PubChem CID756688
Molecular FormulaC11H17N5
Molecular Weight219.29 g/mol
Exact Mass219.15
IUPAC NameN,N-dipropyl-7H-purin-6-amine
SMILESCCCN(CCC)c1ncnc2nc[nH]c12
InChIInChI=1S/C11H17N5/c1-3-5-16(6-4-2)11-9-10(13-7-12-9)14-8-15-11/h7-8H,3-6H2,1-2H3,(H,12,13,14,15)
InChIKeyZUASHJRECBALLE-UHFFFAOYSA-N
XLogP1.98
TPSA57.70 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N,N-dipropyl-7H-purin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-dipropyl-7H-purin-6-amine?
The IUPAC name of N,N-dipropyl-7H-purin-6-amine (CID 756688) is N,N-dipropyl-7H-purin-6-amine.
What is the SMILES notation for N,N-dipropyl-7H-purin-6-amine?
The canonical SMILES for N,N-dipropyl-7H-purin-6-amine is CCCN(CCC)c1ncnc2nc[nH]c12.
What is the InChIKey of N,N-dipropyl-7H-purin-6-amine?
The InChIKey is ZUASHJRECBALLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5/c1-3-5-16(6-4-2)11-9-10(13-7-12-9)14-8-15-11/h7-8H,3-6H2,1-2H3,(H,12,13,14,15).
What are the key properties of N,N-dipropyl-7H-purin-6-amine?
N,N-dipropyl-7H-purin-6-amine has a molecular weight of 219.29 g/mol, XLogP of 1.98, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropyl-7H-purin-6-amine is sourced from PubChem (CID 756688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).