4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine

C11H17N5O3 — CID 104568194

IUPAC4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine
SMILESCNc1nc(OCCOCCOC)c2cn[nH]c2n1
InChIInChI=1S/C11H17N5O3/c1-12-11-14-9-8(7-13-16-9)10(15-11)19-6-5-18-4-3-17-2/h7H,3-6H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyCDEJACKYLFPBNR-UHFFFAOYSA-N
MW267.29 g/mol
LogP0.44
Rot. Bonds8

About 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine

4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine (PubChem CID 104568194) has the molecular formula C11H17N5O3 and a molecular weight of 267.29 g/mol. Its IUPAC name is 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine.

Molecular Properties

Compound Name4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine
PubChem CID104568194
Molecular FormulaC11H17N5O3
Molecular Weight267.29 g/mol
Exact Mass267.13
IUPAC Name4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine
SMILESCNc1nc(OCCOCCOC)c2cn[nH]c2n1
InChIInChI=1S/C11H17N5O3/c1-12-11-14-9-8(7-13-16-9)10(15-11)19-6-5-18-4-3-17-2/h7H,3-6H2,1-2H3,(H2,12,13,14,15,16)
InChIKeyCDEJACKYLFPBNR-UHFFFAOYSA-N
XLogP0.44
TPSA94.18 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.29
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-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

[4-[3-(2-methoxyethoxy)propoxy]-1H-pyrazolo[5,4-d]pyrimidin-6-yl]hydrazine
CID 103408623
5,9-bis(2-methoxyethoxy)-3H-pyrazolo[5,4-c]isoquinoline
CID 123333746
4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N,6-dimethylpyrimidin-2-amine
CID 104568171
6-[2-(2-methoxyethoxy)ethyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine
CID 67144956
5-methoxy-6-[2-(2-methoxyethoxy)ethoxy]-N-methylpyrimidin-4-amine
CID 104568270
4-(2-cyclopropylethoxy)-N-ethyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine
CID 114158228
4-[2-(2-methoxyethoxy)ethoxy]-N-methylpyrimidin-2-amine
CID 104568221
[5-fluoro-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]pyrimidin-2-yl]hydrazine
CID 104568409
N-ethyl-4-[2-(2-methoxyethoxy)ethoxy]-5-methylpyrimidin-2-amine
CID 113427596
6-(2-butoxyethoxy)-N-methyl-7H-purin-2-amine
CID 114786789
4-[2-(2-methoxyethoxy)ethoxy]-5-methyl-N-propylpyrimidin-2-amine
CID 104568288
[1-[2-(2-methoxyethoxy)ethoxy]isoquinolin-3-yl]methanamine
CID 104566277

Frequently Asked Questions

What is the IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine?
The IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine (CID 104568194) is 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine.
What is the SMILES notation for 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine?
The canonical SMILES for 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine is CNc1nc(OCCOCCOC)c2cn[nH]c2n1.
What is the InChIKey of 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine?
The InChIKey is CDEJACKYLFPBNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O3/c1-12-11-14-9-8(7-13-16-9)10(15-11)19-6-5-18-4-3-17-2/h7H,3-6H2,1-2H3,(H2,12,13,14,15,16).
What are the key properties of 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine?
4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine has a molecular weight of 267.29 g/mol, XLogP of 0.44, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyethoxy)ethoxy]-N-methyl-1H-pyrazolo[5,4-d]pyrimidin-6-amine is sourced from PubChem (CID 104568194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).