3-(1-methylpyrazol-4-yl)piperidine

C9H15N3 — CID 62405677

IUPAC3-(1-methylpyrazol-4-yl)piperidine
SMILESCn1cc(C2CCCNC2)cn1
InChIInChI=1S/C9H15N3/c1-12-7-9(6-11-12)8-3-2-4-10-5-8/h6-8,10H,2-5H2,1H3
InChIKeyCTNNCYGEVJOKGG-UHFFFAOYSA-N
MW165.24 g/mol
LogP0.89
Rot. Bonds1

About 3-(1-methylpyrazol-4-yl)piperidine

3-(1-methylpyrazol-4-yl)piperidine (PubChem CID 62405677) has the molecular formula C9H15N3 and a molecular weight of 165.24 g/mol. Its IUPAC name is 3-(1-methylpyrazol-4-yl)piperidine.

Molecular Properties

Compound Name3-(1-methylpyrazol-4-yl)piperidine
PubChem CID62405677
Molecular FormulaC9H15N3
Molecular Weight165.24 g/mol
Exact Mass165.13
IUPAC Name3-(1-methylpyrazol-4-yl)piperidine
SMILESCn1cc(C2CCCNC2)cn1
InChIInChI=1S/C9H15N3/c1-12-7-9(6-11-12)8-3-2-4-10-5-8/h6-8,10H,2-5H2,1H3
InChIKeyCTNNCYGEVJOKGG-UHFFFAOYSA-N
XLogP0.89
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.24
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(1-methylpyrazol-4-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

Related Compounds

1-methyl-4-(pyrrolidin-2-yl)-1H-pyrazole
CID 25248267
3-(1H-pyrazol-4-yl)piperidine
CID 53612880
2-(1-methyl-1H-pyrazol-4-yl)piperidine
CID 63085164
rac-(1R,2S)-2-(1-methyl-1H-pyrazol-4-yl)cyclopropan-1-amine dihydrochloride
CID 91647633
rac-((1R,2R)-2-(1-methyl-1H-pyrazol-4-yl)cyclopropyl)methanamine dihydrochloride
CID 129841821
4-[(4-methyl-1H-pyrazol-1-yl)methyl]piperidine
CID 46318291
4-(1-ethyl-1H-pyrazol-4-yl)piperidine
CID 50987960
alpha-Ethyl-1-methyl-1H-pyrazole-4-methanamine
CID 23005813
2-methyl-1-(1-methyl-1H-pyrazol-4-yl)propan-1-amine
CID 43124222
alpha,1-Dimethyl-1H-pyrazole-4-ethanamine
CID 43199853
3-(1-methyl-1H-pyrazol-4-yl)propan-1-amine
CID 47003365
1-methyl-4-(pyrrolidin-3-yl)-1H-pyrazole
CID 54593929

Frequently Asked Questions

What is the IUPAC name of 3-(1-methylpyrazol-4-yl)piperidine?
The IUPAC name of 3-(1-methylpyrazol-4-yl)piperidine (CID 62405677) is 3-(1-methylpyrazol-4-yl)piperidine.
What is the SMILES notation for 3-(1-methylpyrazol-4-yl)piperidine?
The canonical SMILES for 3-(1-methylpyrazol-4-yl)piperidine is Cn1cc(C2CCCNC2)cn1.
What is the InChIKey of 3-(1-methylpyrazol-4-yl)piperidine?
The InChIKey is CTNNCYGEVJOKGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3/c1-12-7-9(6-11-12)8-3-2-4-10-5-8/h6-8,10H,2-5H2,1H3.
What are the key properties of 3-(1-methylpyrazol-4-yl)piperidine?
3-(1-methylpyrazol-4-yl)piperidine has a molecular weight of 165.24 g/mol, XLogP of 0.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methylpyrazol-4-yl)piperidine is sourced from PubChem (CID 62405677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).