2-N,6-N-dipropyl-7H-purine-2,6-diamine

C11H18N6 — CID 114783634

IUPAC2-N,6-N-dipropyl-7H-purine-2,6-diamine
SMILESCCCNc1nc(NCCC)c2[nH]cnc2n1
InChIInChI=1S/C11H18N6/c1-3-5-12-9-8-10(15-7-14-8)17-11(16-9)13-6-4-2/h7H,3-6H2,1-2H3,(H3,12,13,14,15,16,17)
InChIKeyUZFRCLFWMNGZTQ-UHFFFAOYSA-N
MW234.31 g/mol
LogP2.00
Rot. Bonds6

About 2-N,6-N-dipropyl-7H-purine-2,6-diamine

2-N,6-N-dipropyl-7H-purine-2,6-diamine (PubChem CID 114783634) has the molecular formula C11H18N6 and a molecular weight of 234.31 g/mol. Its IUPAC name is 2-N,6-N-dipropyl-7H-purine-2,6-diamine.

Molecular Properties

Compound Name2-N,6-N-dipropyl-7H-purine-2,6-diamine
PubChem CID114783634
Molecular FormulaC11H18N6
Molecular Weight234.31 g/mol
Exact Mass234.16
IUPAC Name2-N,6-N-dipropyl-7H-purine-2,6-diamine
SMILESCCCNc1nc(NCCC)c2[nH]cnc2n1
InChIInChI=1S/C11H18N6/c1-3-5-12-9-8-10(15-7-14-8)17-11(16-9)13-6-4-2/h7H,3-6H2,1-2H3,(H3,12,13,14,15,16,17)
InChIKeyUZFRCLFWMNGZTQ-UHFFFAOYSA-N
XLogP2.00
TPSA78.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 52.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

6-N-(2-methoxyethyl)-2-N-propyl-7H-purine-2,6-diamine
CID 114783641
6-N-(2,2-dimethylpropyl)-2-N-propyl-7H-purine-2,6-diamine
CID 114784070
6-N-(2-methylbutan-2-yl)-2-N-propyl-7H-purine-2,6-diamine
CID 114783401
1-[[2-(propylamino)-7H-purin-6-yl]amino]propan-2-ol
CID 114783868
6-N-[2-[cyclopropyl(methyl)amino]ethyl]-2-N-propyl-7H-purine-2,6-diamine
CID 114785089
2-methyl-2-[[2-(propylamino)-7H-purin-6-yl]amino]propane-1,3-diol
CID 114785802
2-N-ethyl-6-N-octyl-7H-purine-2,6-diamine
CID 114785797
2-chloro-N-propyl-7H-purin-6-amine
CID 22149709
6-N-propyl-7H-purine-2,6-diamine
CID 22916641
3-[[[2-(propylamino)-7H-purin-6-yl]amino]methyl]cyclobutan-1-ol
CID 114785534
6-N-(1-methylcyclopentyl)-2-N-propyl-7H-purine-2,6-diamine
CID 114785405
6-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2-N-propyl-7H-purine-2,6-diamine
CID 106411749

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-dipropyl-7H-purine-2,6-diamine?
The IUPAC name of 2-N,6-N-dipropyl-7H-purine-2,6-diamine (CID 114783634) is 2-N,6-N-dipropyl-7H-purine-2,6-diamine.
What is the SMILES notation for 2-N,6-N-dipropyl-7H-purine-2,6-diamine?
The canonical SMILES for 2-N,6-N-dipropyl-7H-purine-2,6-diamine is CCCNc1nc(NCCC)c2[nH]cnc2n1.
What is the InChIKey of 2-N,6-N-dipropyl-7H-purine-2,6-diamine?
The InChIKey is UZFRCLFWMNGZTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6/c1-3-5-12-9-8-10(15-7-14-8)17-11(16-9)13-6-4-2/h7H,3-6H2,1-2H3,(H3,12,13,14,15,16,17).
What are the key properties of 2-N,6-N-dipropyl-7H-purine-2,6-diamine?
2-N,6-N-dipropyl-7H-purine-2,6-diamine has a molecular weight of 234.31 g/mol, XLogP of 2.00, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-dipropyl-7H-purine-2,6-diamine is sourced from PubChem (CID 114783634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).