4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine

C15H27N3 — CID 114272276

IUPAC4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine
SMILESCCc1cc(CC2CC(C)NC(C)C2)n(CC)n1
InChIInChI=1S/C15H27N3/c1-5-14-10-15(18(6-2)17-14)9-13-7-11(3)16-12(4)8-13/h10-13,16H,5-9H2,1-4H3
InChIKeyDGGZCZOATDTEFW-UHFFFAOYSA-N
MW249.40 g/mol
LogP2.78
Rot. Bonds4

About 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine

4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine (PubChem CID 114272276) has the molecular formula C15H27N3 and a molecular weight of 249.40 g/mol. Its IUPAC name is 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine.

Molecular Properties

Compound Name4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine
PubChem CID114272276
Molecular FormulaC15H27N3
Molecular Weight249.40 g/mol
Exact Mass249.22
IUPAC Name4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine
SMILESCCc1cc(CC2CC(C)NC(C)C2)n(CC)n1
InChIInChI=1S/C15H27N3/c1-5-14-10-15(18(6-2)17-14)9-13-7-11(3)16-12(4)8-13/h10-13,16H,5-9H2,1-4H3
InChIKeyDGGZCZOATDTEFW-UHFFFAOYSA-N
XLogP2.78
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.40
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(azetidin-3-ylmethylsulfanylmethyl)-1,3-diethylpyrazole
CID 66289931
3-[(1,3-diethylpyrazol-5-yl)methyl]pyrrolidin-2-one
CID 104679348
1-[2-[(1,3-diethylpyrazol-5-yl)methyl]cyclobutyl]-N-methylmethanamine
CID 81016860
3-[(1,3-diethylpyrazol-5-yl)methyl]oxan-4-one
CID 106468863
2-[(1,3-diethylpyrazol-5-yl)methyl]cyclohexane-1-carboxylic acid
CID 81008075
3-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-5-methylpiperidine
CID 106780178
N-[[2-[(1,3-diethylpyrazol-5-yl)methyl]cyclobutyl]methyl]ethanamine
CID 81018330
N-[[2-[(1,3-diethylpyrazol-5-yl)methyl]cyclobutyl]methyl]cyclopropanamine
CID 81017024
1-[(1,3-diethylpyrazol-5-yl)methyl]-3,5-diethylpyrazole
CID 82699372
5-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-2-methylpiperidine
CID 106780199
(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
CID 82755426
N-[[2-[(1,3-diethylpyrazol-5-yl)methyl]cyclopentyl]methyl]cyclopropanamine
CID 81033085

Frequently Asked Questions

What is the IUPAC name of 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine?
The IUPAC name of 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine (CID 114272276) is 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine.
What is the SMILES notation for 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine?
The canonical SMILES for 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine is CCc1cc(CC2CC(C)NC(C)C2)n(CC)n1.
What is the InChIKey of 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine?
The InChIKey is DGGZCZOATDTEFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3/c1-5-14-10-15(18(6-2)17-14)9-13-7-11(3)16-12(4)8-13/h10-13,16H,5-9H2,1-4H3.
What are the key properties of 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine?
4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine has a molecular weight of 249.40 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1,3-diethylpyrazol-5-yl)methyl]-2,6-dimethylpiperidine is sourced from PubChem (CID 114272276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).