1-(5-ethylpiperidin-2-yl)-4-methylpiperazine

C12H25N3 — CID 123136191

IUPAC1-(5-ethylpiperidin-2-yl)-4-methylpiperazine
SMILESCCC1CCC(N2CCN(C)CC2)NC1
InChIInChI=1S/C12H25N3/c1-3-11-4-5-12(13-10-11)15-8-6-14(2)7-9-15/h11-13H,3-10H2,1-2H3
InChIKeyGQZUBXPSHLFOJL-UHFFFAOYSA-N
MW211.35 g/mol
LogP0.97
Rot. Bonds2

About 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine

1-(5-ethylpiperidin-2-yl)-4-methylpiperazine (PubChem CID 123136191) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(5-ethylpiperidin-2-yl)-4-methylpiperazine
PubChem CID123136191
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name1-(5-ethylpiperidin-2-yl)-4-methylpiperazine
SMILESCCC1CCC(N2CCN(C)CC2)NC1
InChIInChI=1S/C12H25N3/c1-3-11-4-5-12(13-10-11)15-8-6-14(2)7-9-15/h11-13H,3-10H2,1-2H3
InChIKeyGQZUBXPSHLFOJL-UHFFFAOYSA-N
XLogP0.97
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-4-[(2S)-pyrrolidin-2-yl]piperazine
CID 129370918
2-(4-methylpiperazin-1-yl)azepane
CID 57005564
6-ethyl-1,4-dimethyl-1,4-diazocane
CID 174327849
(5R)-5-ethyl-2-methylpiperidine
CID 89383563
4-ethyl-1-methylpiperidine;methoxymethane
CID 90698783
1,6-dimethyl-4-(4-methylpiperazin-1-yl)-1,3-diazinane
CID 163677810
4-ethyl-1-methylpiperidine;formonitrile
CID 175849532
1,4-diethylpiperidine;1-ethyl-4-methylpiperazine
CID 143157970
1-(azetidin-3-yl)-4-(3-ethylcyclopentyl)piperazine
CID 66202501
1-[3-(4-ethylcyclohexyl)propyl]-4-(1-methylpiperidin-4-yl)piperazine
CID 166946013
2-[(2S,5R)-5-ethylpiperidin-2-yl]ethanamine
CID 97297925
1-[(2S,5R)-5-ethylpiperidin-2-yl]ethanone
CID 160982260

Frequently Asked Questions

What is the IUPAC name of 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine?
The IUPAC name of 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine (CID 123136191) is 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine.
What is the SMILES notation for 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine?
The canonical SMILES for 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine is CCC1CCC(N2CCN(C)CC2)NC1.
What is the InChIKey of 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine?
The InChIKey is GQZUBXPSHLFOJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-3-11-4-5-12(13-10-11)15-8-6-14(2)7-9-15/h11-13H,3-10H2,1-2H3.
What are the key properties of 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine?
1-(5-ethylpiperidin-2-yl)-4-methylpiperazine has a molecular weight of 211.35 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-ethylpiperidin-2-yl)-4-methylpiperazine is sourced from PubChem (CID 123136191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).