8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine

C10H15N5O3 — CID 143018174

IUPAC8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine
SMILESCOCCOc1nc(N)c2nc(OC)n(C)c2n1
InChIInChI=1S/C10H15N5O3/c1-15-8-6(12-10(15)17-3)7(11)13-9(14-8)18-5-4-16-2/h4-5H2,1-3H3,(H2,11,13,14)
InChIKeyKIKXPNKPCFJDRO-UHFFFAOYSA-N
MW253.26 g/mol
LogP-0.02
Rot. Bonds5

About 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine

8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine (PubChem CID 143018174) has the molecular formula C10H15N5O3 and a molecular weight of 253.26 g/mol. Its IUPAC name is 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine.

Molecular Properties

Compound Name8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine
PubChem CID143018174
Molecular FormulaC10H15N5O3
Molecular Weight253.26 g/mol
Exact Mass253.12
IUPAC Name8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine
SMILESCOCCOc1nc(N)c2nc(OC)n(C)c2n1
InChIInChI=1S/C10H15N5O3/c1-15-8-6(12-10(15)17-3)7(11)13-9(14-8)18-5-4-16-2/h4-5H2,1-3H3,(H2,11,13,14)
InChIKeyKIKXPNKPCFJDRO-UHFFFAOYSA-N
XLogP-0.02
TPSA97.31 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-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

Related Compounds

9-(4-bromobutyl)-2-butoxy-8-methoxypurin-6-amine
CID 23158511
9-[(3Z,5E)-5-(chloromethyl)-2-methylidenehepta-3,5-dienyl]-8-methoxy-2-(2-methoxyethoxy)purin-6-amine
CID 143428445
2-butoxy-9-[6-(4-ethylpiperazin-1-yl)hexyl]-8-methoxypurin-6-amine
CID 58291076
2-butoxy-9-[5-(4-ethylpiperazin-1-yl)pentyl]-8-methoxypurin-6-amine
CID 58291024
[6-amino-9-ethyl-2-(2-methoxyethoxy)purin-8-yl] 5-chloropentyl carbonate
CID 143018213
2-butoxy-9-[3-(4-ethylpiperazin-1-yl)propyl]-8-methoxypurin-6-amine
CID 58291008
2-[2-[6-amino-2-(2-methoxyethoxy)purin-9-yl]phenyl]ethanol
CID 68844363
9-[[2-chloro-5-[4-(pyrrolidin-1-ylmethyl)phenyl]phenyl]methyl]-8-methoxy-2-(2-methoxyethoxy)purin-6-amine
CID 58234541
9-benzyl-8-methoxy-2-pentoxypurin-6-amine
CID 11024299
2-[2-(6-amino-2-butoxy-8-methoxypurin-9-yl)ethyl]isoindole-1,3-dione
CID 58942876
1-[2-[6-amino-8-bromo-2-(2-methoxyethoxy)purin-9-yl]ethoxy]ethyl-butan-2-yloxyphosphinic acid
CID 87621103
3-(6-amino-2-butoxy-8-methoxypurin-9-yl)propyl-tert-butylcarbamic acid
CID 66781348

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine?
The IUPAC name of 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine (CID 143018174) is 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine.
What is the SMILES notation for 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine?
The canonical SMILES for 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine is COCCOc1nc(N)c2nc(OC)n(C)c2n1.
What is the InChIKey of 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine?
The InChIKey is KIKXPNKPCFJDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O3/c1-15-8-6(12-10(15)17-3)7(11)13-9(14-8)18-5-4-16-2/h4-5H2,1-3H3,(H2,11,13,14).
What are the key properties of 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine?
8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine has a molecular weight of 253.26 g/mol, XLogP of -0.02, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-(2-methoxyethoxy)-9-methylpurin-6-amine is sourced from PubChem (CID 143018174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).