4-methyl-1-(2-methylpyrazol-3-yl)piperidine

C10H17N3 — CID 130250395

IUPAC4-methyl-1-(2-methylpyrazol-3-yl)piperidine
SMILESCC1CCN(c2ccnn2C)CC1
InChIInChI=1S/C10H17N3/c1-9-4-7-13(8-5-9)10-3-6-11-12(10)2/h3,6,9H,4-5,7-8H2,1-2H3
InChIKeyCHBXWMOVSLMPJG-UHFFFAOYSA-N
MW179.27 g/mol
LogP1.66
Rot. Bonds1

About 4-methyl-1-(2-methylpyrazol-3-yl)piperidine

4-methyl-1-(2-methylpyrazol-3-yl)piperidine (PubChem CID 130250395) has the molecular formula C10H17N3 and a molecular weight of 179.27 g/mol. Its IUPAC name is 4-methyl-1-(2-methylpyrazol-3-yl)piperidine.

Molecular Properties

Compound Name4-methyl-1-(2-methylpyrazol-3-yl)piperidine
PubChem CID130250395
Molecular FormulaC10H17N3
Molecular Weight179.27 g/mol
Exact Mass179.14
IUPAC Name4-methyl-1-(2-methylpyrazol-3-yl)piperidine
SMILESCC1CCN(c2ccnn2C)CC1
InChIInChI=1S/C10H17N3/c1-9-4-7-13(8-5-9)10-3-6-11-12(10)2/h3,6,9H,4-5,7-8H2,1-2H3
InChIKeyCHBXWMOVSLMPJG-UHFFFAOYSA-N
XLogP1.66
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.27
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-(2-methylpyrazol-3-yl)piperidine?
The IUPAC name of 4-methyl-1-(2-methylpyrazol-3-yl)piperidine (CID 130250395) is 4-methyl-1-(2-methylpyrazol-3-yl)piperidine.
What is the SMILES notation for 4-methyl-1-(2-methylpyrazol-3-yl)piperidine?
The canonical SMILES for 4-methyl-1-(2-methylpyrazol-3-yl)piperidine is CC1CCN(c2ccnn2C)CC1.
What is the InChIKey of 4-methyl-1-(2-methylpyrazol-3-yl)piperidine?
The InChIKey is CHBXWMOVSLMPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3/c1-9-4-7-13(8-5-9)10-3-6-11-12(10)2/h3,6,9H,4-5,7-8H2,1-2H3.
What are the key properties of 4-methyl-1-(2-methylpyrazol-3-yl)piperidine?
4-methyl-1-(2-methylpyrazol-3-yl)piperidine has a molecular weight of 179.27 g/mol, XLogP of 1.66, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-(2-methylpyrazol-3-yl)piperidine is sourced from PubChem (CID 130250395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).