1-(pyrrolidin-2-ylmethyl)pyrazole

C8H13N3 — CID 25220770

IUPAC1-(pyrrolidin-2-ylmethyl)pyrazole
SMILESc1cnn(CC2CCCN2)c1
InChIInChI=1S/C8H13N3/c1-3-8(9-4-1)7-11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2
InChIKeyNROSSDZFPHQESU-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.64
Rot. Bonds2

About 1-(pyrrolidin-2-ylmethyl)pyrazole

1-(pyrrolidin-2-ylmethyl)pyrazole (PubChem CID 25220770) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 1-(pyrrolidin-2-ylmethyl)pyrazole.

Molecular Properties

Compound Name1-(pyrrolidin-2-ylmethyl)pyrazole
PubChem CID25220770
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name1-(pyrrolidin-2-ylmethyl)pyrazole
SMILESc1cnn(CC2CCCN2)c1
InChIInChI=1S/C8H13N3/c1-3-8(9-4-1)7-11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2
InChIKeyNROSSDZFPHQESU-UHFFFAOYSA-N
XLogP0.64
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(pyrrolidin-2-ylmethyl)pyrazole 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-(pyrrolidin-2-ylmethyl)pyrazole?
The IUPAC name of 1-(pyrrolidin-2-ylmethyl)pyrazole (CID 25220770) is 1-(pyrrolidin-2-ylmethyl)pyrazole.
What is the SMILES notation for 1-(pyrrolidin-2-ylmethyl)pyrazole?
The canonical SMILES for 1-(pyrrolidin-2-ylmethyl)pyrazole is c1cnn(CC2CCCN2)c1.
What is the InChIKey of 1-(pyrrolidin-2-ylmethyl)pyrazole?
The InChIKey is NROSSDZFPHQESU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-3-8(9-4-1)7-11-6-2-5-10-11/h2,5-6,8-9H,1,3-4,7H2.
What are the key properties of 1-(pyrrolidin-2-ylmethyl)pyrazole?
1-(pyrrolidin-2-ylmethyl)pyrazole has a molecular weight of 151.21 g/mol, XLogP of 0.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(pyrrolidin-2-ylmethyl)pyrazole is sourced from PubChem (CID 25220770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).