1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile

C11H10N4 — CID 84774894

IUPAC1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile
SMILESN#CC1(c2cnc3ccnn3c2)CCC1
InChIInChI=1S/C11H10N4/c12-8-11(3-1-4-11)9-6-13-10-2-5-14-15(10)7-9/h2,5-7H,1,3-4H2
InChIKeyULRNSUGDHWKMAI-UHFFFAOYSA-N
MW198.23 g/mol
LogP1.67
Rot. Bonds1

About 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile

1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile (PubChem CID 84774894) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile.

Molecular Properties

Compound Name1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile
PubChem CID84774894
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile
SMILESN#CC1(c2cnc3ccnn3c2)CCC1
InChIInChI=1S/C11H10N4/c12-8-11(3-1-4-11)9-6-13-10-2-5-14-15(10)7-9/h2,5-7H,1,3-4H2
InChIKeyULRNSUGDHWKMAI-UHFFFAOYSA-N
XLogP1.67
TPSA53.98 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile 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-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile?
The IUPAC name of 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile (CID 84774894) is 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile.
What is the SMILES notation for 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile?
The canonical SMILES for 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile is N#CC1(c2cnc3ccnn3c2)CCC1.
What is the InChIKey of 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile?
The InChIKey is ULRNSUGDHWKMAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c12-8-11(3-1-4-11)9-6-13-10-2-5-14-15(10)7-9/h2,5-7H,1,3-4H2.
What are the key properties of 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile?
1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile has a molecular weight of 198.23 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrazolo[1,5-a]pyrimidin-6-ylcyclobutane-1-carbonitrile is sourced from PubChem (CID 84774894), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).