1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine

C20H44N4 — CID 142867128

IUPAC1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine
SMILESCC1CCN(C)CC1.CCN1CCCCC1.CN1CCN(C)CC1
InChIInChI=1S/2C7H15N.C6H14N2/c1-7-3-5-8(2)6-4-7;1-2-8-6-4-3-5-7-8;1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3;2-7H2,1H3;3-6H2,1-2H3
InChIKeyYXTPSIGXJLCPSN-UHFFFAOYSA-N
MW340.60 g/mol
LogP2.70
Rot. Bonds1

About 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine

1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine (PubChem CID 142867128) has the molecular formula C20H44N4 and a molecular weight of 340.60 g/mol. Its IUPAC name is 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine.

Molecular Properties

Compound Name1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine
PubChem CID142867128
Molecular FormulaC20H44N4
Molecular Weight340.60 g/mol
Exact Mass340.36
IUPAC Name1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine
SMILESCC1CCN(C)CC1.CCN1CCCCC1.CN1CCN(C)CC1
InChIInChI=1S/2C7H15N.C6H14N2/c1-7-3-5-8(2)6-4-7;1-2-8-6-4-3-5-7-8;1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3;2-7H2,1H3;3-6H2,1-2H3
InChIKeyYXTPSIGXJLCPSN-UHFFFAOYSA-N
XLogP2.70
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.60
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Piperazine, 1,4-bis(3-piperidinoethyl)-
CID 211252
1-Methyl-1-azoniabicyclo[2.2.2]octane
CID 155481
Piperidinium, 1,1'-(1,4-piperazinediyldiethylene)bis(1-ethyl-, diiodide
CID 199669
Piperidinium, 1,1'-(1,4-piperazinediyldiethylene)bis(1-methyl-, diiodide
CID 3063128
Piperidinium, 1,1'-(1,4-piperazinediyldiethylene)bis(1-ethyl-, dibromide
CID 24842955
1-Ethyl-1-azabicyclo[2.2.2]octan-1-ium
CID 13652288
1-Propyl-1-azoniabicyclo[2.2.2]octane
CID 14642664
1-Butyl-1-azoniabicyclo[2.2.2]octane
CID 14642666
Diethyl-methyl-(3-quinuclidin-1-ium-1-ylpropyl)ammonium
CID 409130
(9aS)-8-methyl-2-[(1-propan-2-ylpiperidin-4-yl)methyl]-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine
CID 98741869
1-[2-[1-[2-(4,4-Difluoropiperidin-1-yl)ethyl]piperidin-4-yl]ethyl]-4-methylpiperazine
CID 170253919
1-[3,3-Difluoro-1-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidin-4-yl]-4-propan-2-ylpiperazine
CID 171723127

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine?
The IUPAC name of 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine (CID 142867128) is 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine.
What is the SMILES notation for 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine?
The canonical SMILES for 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine is CC1CCN(C)CC1.CCN1CCCCC1.CN1CCN(C)CC1.
What is the InChIKey of 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine?
The InChIKey is YXTPSIGXJLCPSN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H15N.C6H14N2/c1-7-3-5-8(2)6-4-7;1-2-8-6-4-3-5-7-8;1-7-3-5-8(2)6-4-7/h7H,3-6H2,1-2H3;2-7H2,1H3;3-6H2,1-2H3.
What are the key properties of 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine?
1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine has a molecular weight of 340.60 g/mol, XLogP of 2.70, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperazine;1,4-dimethylpiperidine;1-ethylpiperidine is sourced from PubChem (CID 142867128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).