3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride

C9H16ClN3 — CID 112756464

IUPAC3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride
SMILESCc1cc(C2CCCNC2)n[nH]1.Cl
InChIInChI=1S/C9H15N3.ClH/c1-7-5-9(12-11-7)8-3-2-4-10-6-8;/h5,8,10H,2-4,6H2,1H3,(H,11,12);1H
InChIKeyDRSSVRMCIXUQRT-UHFFFAOYSA-N
MW201.70 g/mol
LogP1.61
Rot. Bonds1

About 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride

3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride (PubChem CID 112756464) has the molecular formula C9H16ClN3 and a molecular weight of 201.70 g/mol. Its IUPAC name is 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride.

Molecular Properties

Compound Name3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride
PubChem CID112756464
Molecular FormulaC9H16ClN3
Molecular Weight201.70 g/mol
Exact Mass201.10
IUPAC Name3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride
SMILESCc1cc(C2CCCNC2)n[nH]1.Cl
InChIInChI=1S/C9H15N3.ClH/c1-7-5-9(12-11-7)8-3-2-4-10-6-8;/h5,8,10H,2-4,6H2,1H3,(H,11,12);1H
InChIKeyDRSSVRMCIXUQRT-UHFFFAOYSA-N
XLogP1.61
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.70
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(1H-Pyrazol-5-yl)piperidine
CID 21193114
3-(1H-pyrazol-5-yl)piperidine
CID 42961301
1-[(3-cyclohexyl-1H-pyrazol-5-yl)methyl]piperidine
CID 786815
3,5-Diisopropylpyrazole
CID 5255229
((5-tert-butyl-1H-pyrazol-3-yl)methyl)(methyl)amine
CID 44236865
1-(5-Cyclopropyl-1H-pyrazol-3-YL)-N-methylmethanamine
CID 44236867
3-(piperidin-4-yl)-1H-pyrazol-5-amine
CID 45792668
4-(1H-pyrazol-5-ylmethyl)piperidine
CID 75355610
3-(1H-pyrazol-5-yl)piperidine dihydrochloride
CID 42961300
3-[3-(propan-2-yl)-1H-pyrazol-5-yl]piperidine
CID 71695345
1-[(3,5-dimethyl-1H-pyrazol-4-yl)methyl]-4-(3-isopropyl-1H-pyrazol-5-yl)piperidine
CID 56710882
1-isobutyl-N-[1-methyl-2-(3-methyl-1H-pyrazol-5-yl)ethyl]piperidin-4-amine
CID 56712928

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride?
The IUPAC name of 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride (CID 112756464) is 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride.
What is the SMILES notation for 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride?
The canonical SMILES for 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride is Cc1cc(C2CCCNC2)n[nH]1.Cl.
What is the InChIKey of 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride?
The InChIKey is DRSSVRMCIXUQRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3.ClH/c1-7-5-9(12-11-7)8-3-2-4-10-6-8;/h5,8,10H,2-4,6H2,1H3,(H,11,12);1H.
What are the key properties of 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride?
3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride has a molecular weight of 201.70 g/mol, XLogP of 1.61, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1H-pyrazol-3-yl)piperidine;hydrochloride is sourced from PubChem (CID 112756464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).