9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine

C14H22N6O — CID 22985712

IUPAC9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine
SMILESCN(C)CCOC1CCC(n2cnc3c(N)ncnc32)C1
InChIInChI=1S/C14H22N6O/c1-19(2)5-6-21-11-4-3-10(7-11)20-9-18-12-13(15)16-8-17-14(12)20/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyYEUNESIYYMQCLB-UHFFFAOYSA-N
MW290.37 g/mol
LogP1.08
Rot. Bonds5

About 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine

9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine (PubChem CID 22985712) has the molecular formula C14H22N6O and a molecular weight of 290.37 g/mol. Its IUPAC name is 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine.

Molecular Properties

Compound Name9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine
PubChem CID22985712
Molecular FormulaC14H22N6O
Molecular Weight290.37 g/mol
Exact Mass290.19
IUPAC Name9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine
SMILESCN(C)CCOC1CCC(n2cnc3c(N)ncnc32)C1
InChIInChI=1S/C14H22N6O/c1-19(2)5-6-21-11-4-3-10(7-11)20-9-18-12-13(15)16-8-17-14(12)20/h8-11H,3-7H2,1-2H3,(H2,15,16,17)
InChIKeyYEUNESIYYMQCLB-UHFFFAOYSA-N
XLogP1.08
TPSA82.09 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 2-[(1R,3R)-3-(6-aminopurin-9-yl)cyclopentyl]acetate
CID 15659288
[3-(6-aminopurin-9-yl)cyclopentyl]-oxophosphanium
CID 173294631
2-[3-(6-aminopurin-9-yl)cyclopentyl]oxy-2-phosphonoacetic acid
CID 90178631
S-[2-[[3-(6-aminopurin-9-yl)cyclopentyl]oxy-(2-benzoylsulfanylethoxy)phosphoryl]oxyethyl] benzenecarbothioate
CID 10168129
9-[2-[2-(dimethylamino)ethoxy]ethyl]purin-6-amine
CID 15334366
9-[(1S,3R)-3-[2-di(propan-2-yloxy)phosphorylethyl]cyclopentyl]purin-6-amine
CID 10475784
9-[3-[1-tri(propan-2-yl)silyloxyethyl]cyclobutyl]purin-6-amine
CID 66739366
[(3S,4S)-3-(6-aminopurin-9-yl)-4-hydroxypyrrolidin-1-yl]-[4-[2-(dimethylamino)ethoxy]phenyl]methanone
CID 110155297
9-[(2R,5R)-5-methyl-4-(2,2,2-tribromoethoxy)oxolan-2-yl]purin-6-amine
CID 67640585
[[3-(6-aminopurin-9-yl)cyclobutyl]oxymethyl-(2,2-dimethylpropanoyloxymethoxy)phosphoryl]oxymethyl 2,2-dimethylpropanoate
CID 90339170
9-[(3S)-piperidin-3-yl]purin-6-amine
CID 51050700
N'-[[5-(6-aminopurin-9-yl)oxolan-2-yl]methyl]-N'-methylethane-1,2-diamine
CID 123204035

Frequently Asked Questions

What is the IUPAC name of 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine?
The IUPAC name of 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine (CID 22985712) is 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine.
What is the SMILES notation for 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine?
The canonical SMILES for 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine is CN(C)CCOC1CCC(n2cnc3c(N)ncnc32)C1.
What is the InChIKey of 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine?
The InChIKey is YEUNESIYYMQCLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N6O/c1-19(2)5-6-21-11-4-3-10(7-11)20-9-18-12-13(15)16-8-17-14(12)20/h8-11H,3-7H2,1-2H3,(H2,15,16,17).
What are the key properties of 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine?
9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine has a molecular weight of 290.37 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[3-[2-(dimethylamino)ethoxy]cyclopentyl]purin-6-amine is sourced from PubChem (CID 22985712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).