3-(1H-pyrazol-5-yl)piperidine

C8H13N3 — CID 42961301

IUPAC3-(1H-pyrazol-5-yl)piperidine
SMILESC1CC(CNC1)C2=CC=NN2
InChIInChI=1S/C8H13N3/c1-2-7(6-9-4-1)8-3-5-10-11-8/h3,5,7,9H,1-2,4,6H2,(H,10,11)
InChIKeyDZMZZFAVAYXTJD-UHFFFAOYSA-N
MW151.21 g/mol
LogP0.40
Rot. Bonds1

About 3-(1H-pyrazol-5-yl)piperidine

3-(1H-pyrazol-5-yl)piperidine (PubChem CID 42961301) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-(1H-pyrazol-5-yl)piperidine.

Molecular Properties

Compound Name3-(1H-pyrazol-5-yl)piperidine
PubChem CID42961301
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name3-(1H-pyrazol-5-yl)piperidine
SMILESC1CC(CNC1)C2=CC=NN2
InChIInChI=1S/C8H13N3/c1-2-7(6-9-4-1)8-3-5-10-11-8/h3,5,7,9H,1-2,4,6H2,(H,10,11)
InChIKeyDZMZZFAVAYXTJD-UHFFFAOYSA-N
XLogP0.40
TPSA40.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity127

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

Betazole
CID 7741
4-(1H-Pyrazol-5-yl)piperidine
CID 21193114
3-Cyclopropyl-1H-pyrazole
CID 7017816
3-(Propan-2-YL)-1H-pyrazole
CID 12251381
4-(3-methyl-1H-pyrazol-4-yl)piperidine
CID 82414450
3-cyclohexyl-1H-pyrazole
CID 10909742
2-(1H-pyrazol-3-yl)piperidine
CID 46737142
4-((1-methyl-1H-pyrazol-5-yl)methyl)piperidine
CID 63961604
4-(1H-pyrazol-5-ylmethyl)piperidine
CID 75355610
4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 2760583
3-(pyrrolidin-2-yl)-1H-pyrazole
CID 23282562
3-cyclobutyl-1H-pyrazole
CID 12108429

Frequently Asked Questions

What is the IUPAC name of 3-(1H-pyrazol-5-yl)piperidine?
The IUPAC name of 3-(1H-pyrazol-5-yl)piperidine (CID 42961301) is 3-(1H-pyrazol-5-yl)piperidine.
What is the SMILES notation for 3-(1H-pyrazol-5-yl)piperidine?
The canonical SMILES for 3-(1H-pyrazol-5-yl)piperidine is C1CC(CNC1)C2=CC=NN2.
What is the InChIKey of 3-(1H-pyrazol-5-yl)piperidine?
The InChIKey is DZMZZFAVAYXTJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-7(6-9-4-1)8-3-5-10-11-8/h3,5,7,9H,1-2,4,6H2,(H,10,11).
What are the key properties of 3-(1H-pyrazol-5-yl)piperidine?
3-(1H-pyrazol-5-yl)piperidine has a molecular weight of 151.21 g/mol, XLogP of 0.40, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1H-pyrazol-5-yl)piperidine is sourced from PubChem (CID 42961301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).