2-pyrazol-1-ylpiperidine

C8H13N3 — CID 83409072

IUPAC2-pyrazol-1-ylpiperidine
SMILESc1cnn(C2CCCCN2)c1
InChIInChI=1S/C8H13N3/c1-2-5-9-8(4-1)11-7-3-6-10-11/h3,6-9H,1-2,4-5H2
InChIKeyCXHGNQHRGFEZKH-UHFFFAOYSA-N
MW151.21 g/mol
LogP1.16
Rot. Bonds1

About 2-pyrazol-1-ylpiperidine

2-pyrazol-1-ylpiperidine (PubChem CID 83409072) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 2-pyrazol-1-ylpiperidine.

Molecular Properties

Compound Name2-pyrazol-1-ylpiperidine
PubChem CID83409072
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name2-pyrazol-1-ylpiperidine
SMILESc1cnn(C2CCCCN2)c1
InChIInChI=1S/C8H13N3/c1-2-5-9-8(4-1)11-7-3-6-10-11/h3,6-9H,1-2,4-5H2
InChIKeyCXHGNQHRGFEZKH-UHFFFAOYSA-N
XLogP1.16
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Serine Hydrolase Inhibitor-11
CID 89847041
4-(1H-Pyrazol-1-yl)piperidine
CID 21193045
3-(1H-pyrazol-1-yl)piperidine
CID 47003266
2-Piperidin-4-yl-2H-pyrazol-3-ylamine
CID 649859
4-(1H-pyrazol-1-yl)piperidine hydrochloride
CID 56766486
4-(1H-pyrazol-1-ylmethyl)piperidine
CID 28063741
N-(4-Amino-butyl)-pyrazole-1-carboxamidine; hydrochloride
CID 44326665
N-butylpyrazole-1-carboxamide
CID 44306377
2-(1H-pyrazol-1-ylmethyl)piperidine
CID 54592627
N-methyl-1-[2-(1H-pyrazol-1-yl)ethyl]piperidin-4-amine
CID 50989058
4-(2-(1H-Pyrazol-1-yl)ethyl)piperidine
CID 28064142
4-(1H-pyrazol-1-yl)piperidine dihydrochloride
CID 45791409

Frequently Asked Questions

What is the IUPAC name of 2-pyrazol-1-ylpiperidine?
The IUPAC name of 2-pyrazol-1-ylpiperidine (CID 83409072) is 2-pyrazol-1-ylpiperidine.
What is the SMILES notation for 2-pyrazol-1-ylpiperidine?
The canonical SMILES for 2-pyrazol-1-ylpiperidine is c1cnn(C2CCCCN2)c1.
What is the InChIKey of 2-pyrazol-1-ylpiperidine?
The InChIKey is CXHGNQHRGFEZKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N3/c1-2-5-9-8(4-1)11-7-3-6-10-11/h3,6-9H,1-2,4-5H2.
What are the key properties of 2-pyrazol-1-ylpiperidine?
2-pyrazol-1-ylpiperidine has a molecular weight of 151.21 g/mol, XLogP of 1.16, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrazol-1-ylpiperidine is sourced from PubChem (CID 83409072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).