4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide

C11H14N6O — CID 134173713

IUPAC4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide
SMILESNC(=O)c1nn(C2CCCC2)c2ncnc(N)c12
InChIInChI=1S/C11H14N6O/c12-9-7-8(10(13)18)16-17(6-3-1-2-4-6)11(7)15-5-14-9/h5-6H,1-4H2,(H2,13,18)(H2,12,14,15)
InChIKeyJPFCOSZHHGSAAN-UHFFFAOYSA-N
MW246.27 g/mol
LogP0.62
Rot. Bonds2

About 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide

4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide (PubChem CID 134173713) has the molecular formula C11H14N6O and a molecular weight of 246.27 g/mol. Its IUPAC name is 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide.

Molecular Properties

Compound Name4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide
PubChem CID134173713
Molecular FormulaC11H14N6O
Molecular Weight246.27 g/mol
Exact Mass246.12
IUPAC Name4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide
SMILESNC(=O)c1nn(C2CCCC2)c2ncnc(N)c12
InChIInChI=1S/C11H14N6O/c12-9-7-8(10(13)18)16-17(6-3-1-2-4-6)11(7)15-5-14-9/h5-6H,1-4H2,(H2,13,18)(H2,12,14,15)
InChIKeyJPFCOSZHHGSAAN-UHFFFAOYSA-N
XLogP0.62
TPSA112.71 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.27
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide 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 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide?
The IUPAC name of 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide (CID 134173713) is 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide.
What is the SMILES notation for 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide?
The canonical SMILES for 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide is NC(=O)c1nn(C2CCCC2)c2ncnc(N)c12.
What is the InChIKey of 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide?
The InChIKey is JPFCOSZHHGSAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N6O/c12-9-7-8(10(13)18)16-17(6-3-1-2-4-6)11(7)15-5-14-9/h5-6H,1-4H2,(H2,13,18)(H2,12,14,15).
What are the key properties of 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide?
4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide has a molecular weight of 246.27 g/mol, XLogP of 0.62, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-cyclopentylpyrazolo[3,4-d]pyrimidine-3-carboxamide is sourced from PubChem (CID 134173713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).