1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine

C13H19N5O — CID 62349109

IUPAC1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine
SMILESCn1ncc2c(OCCC3CCCCN3)ncnc21
InChIInChI=1S/C13H19N5O/c1-18-12-11(8-17-18)13(16-9-15-12)19-7-5-10-4-2-3-6-14-10/h8-10,14H,2-7H2,1H3
InChIKeyJHLVEZOPUJFTQI-UHFFFAOYSA-N
MW261.33 g/mol
LogP1.27
Rot. Bonds4

About 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine

1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine (PubChem CID 62349109) has the molecular formula C13H19N5O and a molecular weight of 261.33 g/mol. Its IUPAC name is 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine
PubChem CID62349109
Molecular FormulaC13H19N5O
Molecular Weight261.33 g/mol
Exact Mass261.16
IUPAC Name1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine
SMILESCn1ncc2c(OCCC3CCCCN3)ncnc21
InChIInChI=1S/C13H19N5O/c1-18-12-11(8-17-18)13(16-9-15-12)19-7-5-10-4-2-3-6-14-10/h8-10,14H,2-7H2,1H3
InChIKeyJHLVEZOPUJFTQI-UHFFFAOYSA-N
XLogP1.27
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.33
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine?
The IUPAC name of 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine (CID 62349109) is 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine.
What is the SMILES notation for 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine?
The canonical SMILES for 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine is Cn1ncc2c(OCCC3CCCCN3)ncnc21.
What is the InChIKey of 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine?
The InChIKey is JHLVEZOPUJFTQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5O/c1-18-12-11(8-17-18)13(16-9-15-12)19-7-5-10-4-2-3-6-14-10/h8-10,14H,2-7H2,1H3.
What are the key properties of 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine?
1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine has a molecular weight of 261.33 g/mol, XLogP of 1.27, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(2-piperidin-2-ylethoxy)pyrazolo[5,4-d]pyrimidine is sourced from PubChem (CID 62349109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).