8-(2-aminoethyl)purine-6,9-diamine

C7H11N7 — CID 57290329

IUPAC8-(2-aminoethyl)purine-6,9-diamine
SMILESNCCc1nc2c(N)ncnc2n1N
InChIInChI=1S/C7H11N7/c8-2-1-4-13-5-6(9)11-3-12-7(5)14(4)10/h3H,1-2,8,10H2,(H2,9,11,12)
InChIKeyFNPDGZBGGQORNS-UHFFFAOYSA-N
MW193.21 g/mol
LogP-1.38
Rot. Bonds2

About 8-(2-aminoethyl)purine-6,9-diamine

8-(2-aminoethyl)purine-6,9-diamine (PubChem CID 57290329) has the molecular formula C7H11N7 and a molecular weight of 193.21 g/mol. Its IUPAC name is 8-(2-aminoethyl)purine-6,9-diamine.

Molecular Properties

Compound Name8-(2-aminoethyl)purine-6,9-diamine
PubChem CID57290329
Molecular FormulaC7H11N7
Molecular Weight193.21 g/mol
Exact Mass193.11
IUPAC Name8-(2-aminoethyl)purine-6,9-diamine
SMILESNCCc1nc2c(N)ncnc2n1N
InChIInChI=1S/C7H11N7/c8-2-1-4-13-5-6(9)11-3-12-7(5)14(4)10/h3H,1-2,8,10H2,(H2,9,11,12)
InChIKeyFNPDGZBGGQORNS-UHFFFAOYSA-N
XLogP-1.38
TPSA121.66 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 5-1.38
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

9-(4-aminobutyl)-8-methylpurin-6-amine
CID 154682706
2-[6-amino-9-(2-phenylethyl)purin-8-yl]ethanol
CID 42637848
3-(aminomethyl)triazolo[4,5-d]pyrimidin-7-amine
CID 146204459
8-bromo-9-methylpurin-6-amine
CID 822296
8-bromo-9-propylpurin-6-amine
CID 11849871
9-[4,6-bis(6-aminopurin-9-yl)-1,3,5-triazin-2-yl]purin-6-amine
CID 102192385
(2R,3R,4S,5R)-2-(6-amino-8-ethylpurin-9-yl)-5-[[3-aminopropyl(methyl)amino]methyl]oxolane-3,4-diol
CID 25233956
4-[6-amino-9-[[tert-butyl(dimethyl)silyl]oxymethyl]purin-8-yl]butan-1-ol
CID 10569967
8-bromo-9-butylpurin-6-amine
CID 11608719
9-(2-aminoethyl)-8-[(6-ethynyl-1,3-benzodioxol-5-yl)sulfanyl]purin-6-amine
CID 87274714
9-(4-aminobut-2-enyl)purin-6-amine
CID 73233001
8,9-dihydro-7H-purino[8,9-b][1,3]thiazin-4-amine
CID 130016922

Frequently Asked Questions

What is the IUPAC name of 8-(2-aminoethyl)purine-6,9-diamine?
The IUPAC name of 8-(2-aminoethyl)purine-6,9-diamine (CID 57290329) is 8-(2-aminoethyl)purine-6,9-diamine.
What is the SMILES notation for 8-(2-aminoethyl)purine-6,9-diamine?
The canonical SMILES for 8-(2-aminoethyl)purine-6,9-diamine is NCCc1nc2c(N)ncnc2n1N.
What is the InChIKey of 8-(2-aminoethyl)purine-6,9-diamine?
The InChIKey is FNPDGZBGGQORNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N7/c8-2-1-4-13-5-6(9)11-3-12-7(5)14(4)10/h3H,1-2,8,10H2,(H2,9,11,12).
What are the key properties of 8-(2-aminoethyl)purine-6,9-diamine?
8-(2-aminoethyl)purine-6,9-diamine has a molecular weight of 193.21 g/mol, XLogP of -1.38, 2 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-aminoethyl)purine-6,9-diamine is sourced from PubChem (CID 57290329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).