1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one

C15H20N6O — CID 133390681

IUPAC1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one
SMILESO=C1CN(c2ncnc3[nH]ncc23)CCN1CC1CCCC1
InChIInChI=1S/C15H20N6O/c22-13-9-21(6-5-20(13)8-11-3-1-2-4-11)15-12-7-18-19-14(12)16-10-17-15/h7,10-11H,1-6,8-9H2,(H,16,17,18,19)
InChIKeyCYCQYPJLOVBXHO-UHFFFAOYSA-N
MW300.37 g/mol
LogP1.19
Rot. Bonds3

About 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one

1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one (PubChem CID 133390681) has the molecular formula C15H20N6O and a molecular weight of 300.37 g/mol. Its IUPAC name is 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one.

Molecular Properties

Compound Name1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one
PubChem CID133390681
Molecular FormulaC15H20N6O
Molecular Weight300.37 g/mol
Exact Mass300.17
IUPAC Name1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one
SMILESO=C1CN(c2ncnc3[nH]ncc23)CCN1CC1CCCC1
InChIInChI=1S/C15H20N6O/c22-13-9-21(6-5-20(13)8-11-3-1-2-4-11)15-12-7-18-19-14(12)16-10-17-15/h7,10-11H,1-6,8-9H2,(H,16,17,18,19)
InChIKeyCYCQYPJLOVBXHO-UHFFFAOYSA-N
XLogP1.19
TPSA78.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.37
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one 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-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one?
The IUPAC name of 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one (CID 133390681) is 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one.
What is the SMILES notation for 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one?
The canonical SMILES for 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one is O=C1CN(c2ncnc3[nH]ncc23)CCN1CC1CCCC1.
What is the InChIKey of 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one?
The InChIKey is CYCQYPJLOVBXHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N6O/c22-13-9-21(6-5-20(13)8-11-3-1-2-4-11)15-12-7-18-19-14(12)16-10-17-15/h7,10-11H,1-6,8-9H2,(H,16,17,18,19).
What are the key properties of 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one?
1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one has a molecular weight of 300.37 g/mol, XLogP of 1.19, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopentylmethyl)-4-(1H-pyrazolo[5,4-d]pyrimidin-4-yl)piperazin-2-one is sourced from PubChem (CID 133390681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).