3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine

C12H19N3 — CID 83833173

IUPAC3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
SMILESCn1nc(C2CC2)cc1C1CCCNC1
InChIInChI=1S/C12H19N3/c1-15-12(10-3-2-6-13-8-10)7-11(14-15)9-4-5-9/h7,9-10,13H,2-6,8H2,1H3
InChIKeyVXUPVIJJSZDYMN-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.76
Rot. Bonds2

About 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine

3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine (PubChem CID 83833173) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine.

Molecular Properties

Compound Name3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
PubChem CID83833173
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine
SMILESCn1nc(C2CC2)cc1C1CCCNC1
InChIInChI=1S/C12H19N3/c1-15-12(10-3-2-6-13-8-10)7-11(14-15)9-4-5-9/h7,9-10,13H,2-6,8H2,1H3
InChIKeyVXUPVIJJSZDYMN-UHFFFAOYSA-N
XLogP1.76
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine 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 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine?
The IUPAC name of 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine (CID 83833173) is 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine.
What is the SMILES notation for 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine?
The canonical SMILES for 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine is Cn1nc(C2CC2)cc1C1CCCNC1.
What is the InChIKey of 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine?
The InChIKey is VXUPVIJJSZDYMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-15-12(10-3-2-6-13-8-10)7-11(14-15)9-4-5-9/h7,9-10,13H,2-6,8H2,1H3.
What are the key properties of 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine?
3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine has a molecular weight of 205.30 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-cyclopropyl-1-methylpyrazol-5-yl)piperidine is sourced from PubChem (CID 83833173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).