2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine

C11H19N3 — CID 130682300

IUPAC2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine
SMILESCc1nn(C)cc1C1CC(C)CCN1
InChIInChI=1S/C11H19N3/c1-8-4-5-12-11(6-8)10-7-14(3)13-9(10)2/h7-8,11-12H,4-6H2,1-3H3
InChIKeyRUPBXWXFNXNRIN-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.79
Rot. Bonds1

About 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine

2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine (PubChem CID 130682300) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine.

Molecular Properties

Compound Name2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine
PubChem CID130682300
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine
SMILESCc1nn(C)cc1C1CC(C)CCN1
InChIInChI=1S/C11H19N3/c1-8-4-5-12-11(6-8)10-7-14(3)13-9(10)2/h7-8,11-12H,4-6H2,1-3H3
InChIKeyRUPBXWXFNXNRIN-UHFFFAOYSA-N
XLogP1.79
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(1,3-dimethylpyrazol-4-yl)ethyl]-4-methylpiperidine
CID 116686145
3-methoxy-1-methyl-4-(4-methylpyrrolidin-2-yl)pyrazole
CID 134540611
(2R,4S)-4-methyl-2-(5-methylfuran-2-yl)piperidine
CID 95566877
4-methyl-5-(4-methylpiperidin-2-yl)-1,3-thiazole
CID 164650987
4-(2-chlorocyclopentyl)-1,3-dimethylpyrazole
CID 130642452
2-(1,3-dimethylpyrazol-4-yl)cyclopentan-1-amine
CID 130699740
[2-(1,3-dimethylpyrazol-4-yl)cyclopropyl]methanamine
CID 83094405
4-[(2S,4R)-4-methylpiperidin-2-yl]phenol
CID 138627789
3-cyclopropyl-1-methyl-4-pyrrolidin-2-ylpyrazole
CID 83829953
2-(3-fluoro-4-methylphenyl)-4-methylpiperidine
CID 115502554
4-methyl-2-(2-phenylpyrazol-3-yl)piperidine
CID 107331171
2-(5-bromo-3-methyltriazol-4-yl)-4-methylpiperidine
CID 106463437

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine?
The IUPAC name of 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine (CID 130682300) is 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine.
What is the SMILES notation for 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine?
The canonical SMILES for 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine is Cc1nn(C)cc1C1CC(C)CCN1.
What is the InChIKey of 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine?
The InChIKey is RUPBXWXFNXNRIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-8-4-5-12-11(6-8)10-7-14(3)13-9(10)2/h7-8,11-12H,4-6H2,1-3H3.
What are the key properties of 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine?
2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine has a molecular weight of 193.29 g/mol, XLogP of 1.79, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dimethylpyrazol-4-yl)-4-methylpiperidine is sourced from PubChem (CID 130682300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).