6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine

C11H16N6 — CID 114783774

IUPAC6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine
SMILESCCNc1nc(N(C)C2CC2)c2[nH]cnc2n1
InChIInChI=1S/C11H16N6/c1-3-12-11-15-9-8(13-6-14-9)10(16-11)17(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyULOSVYDZCBHXCA-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.38
Rot. Bonds4

About 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine

6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine (PubChem CID 114783774) has the molecular formula C11H16N6 and a molecular weight of 232.29 g/mol. Its IUPAC name is 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine.

Molecular Properties

Compound Name6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine
PubChem CID114783774
Molecular FormulaC11H16N6
Molecular Weight232.29 g/mol
Exact Mass232.14
IUPAC Name6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine
SMILESCCNc1nc(N(C)C2CC2)c2[nH]cnc2n1
InChIInChI=1S/C11H16N6/c1-3-12-11-15-9-8(13-6-14-9)10(16-11)17(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyULOSVYDZCBHXCA-UHFFFAOYSA-N
XLogP1.38
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine with MolForge

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Related Compounds

2-N-ethyl-6-N-methyl-6-N-(3-methylcyclohexyl)-7H-purine-2,6-diamine
CID 114784173
2-N,6-N-dimethyl-6-N-(1-methylpiperidin-4-yl)-7H-purine-2,6-diamine
CID 114783544
6-N,6-N-dibutyl-2-N-ethyl-7H-purine-2,6-diamine
CID 114783314
6-N-(cyclopropylmethyl)-6-N-methyl-2-N-propyl-7H-purine-2,6-diamine
CID 114784058
6-N-cyclopentyl-2-N-ethyl-7H-purine-2,6-diamine
CID 114783648
2-[[2-(ethylamino)-7H-purin-6-yl]-propylamino]ethanol
CID 114784127
6-N-(2,2-dicyclopropylethyl)-2-N-ethyl-7H-purine-2,6-diamine
CID 114785499
N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)-7H-purin-2-amine
CID 114786604
2-[[2-(ethylamino)-7H-purin-6-yl]-methylamino]-N-propylacetamide
CID 114784196
2-N-ethyl-6-N-methyl-6-N-[(4-methyl-1,3-thiazol-5-yl)methyl]-7H-purine-2,6-diamine
CID 114785264
1-[1-[2-(ethylamino)-7H-purin-6-yl]pyrrolidin-3-yl]ethanol
CID 114786006
N-ethyl-6-(2-methylcyclohexyl)oxy-7H-purin-2-amine
CID 114786879

Frequently Asked Questions

What is the IUPAC name of 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine?
The IUPAC name of 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine (CID 114783774) is 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine.
What is the SMILES notation for 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine?
The canonical SMILES for 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine is CCNc1nc(N(C)C2CC2)c2[nH]cnc2n1.
What is the InChIKey of 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine?
The InChIKey is ULOSVYDZCBHXCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6/c1-3-12-11-15-9-8(13-6-14-9)10(16-11)17(2)7-4-5-7/h6-7H,3-5H2,1-2H3,(H2,12,13,14,15,16).
What are the key properties of 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine?
6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine has a molecular weight of 232.29 g/mol, XLogP of 1.38, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-cyclopropyl-2-N-ethyl-6-N-methyl-7H-purine-2,6-diamine is sourced from PubChem (CID 114783774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).