1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine

C13H30N4 — CID 160568928

IUPAC1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
SMILESCCN1CCN(C)CC1.CN1CCN(C)CC1
InChIInChI=1S/C7H16N2.C6H14N2/c1-3-9-6-4-8(2)5-7-9;1-7-3-5-8(2)6-4-7/h3-7H2,1-2H3;3-6H2,1-2H3
InChIKeyRAHIRQQEHDVXQB-UHFFFAOYSA-N
MW242.41 g/mol
LogP0.12
Rot. Bonds1

About 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine

1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine (PubChem CID 160568928) has the molecular formula C13H30N4 and a molecular weight of 242.41 g/mol. Its IUPAC name is 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine.

Molecular Properties

Compound Name1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
PubChem CID160568928
Molecular FormulaC13H30N4
Molecular Weight242.41 g/mol
Exact Mass242.25
IUPAC Name1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine
SMILESCCN1CCN(C)CC1.CN1CCN(C)CC1
InChIInChI=1S/C7H16N2.C6H14N2/c1-3-9-6-4-8(2)5-7-9;1-7-3-5-8(2)6-4-7/h3-7H2,1-2H3;3-6H2,1-2H3
InChIKeyRAHIRQQEHDVXQB-UHFFFAOYSA-N
XLogP0.12
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 50.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 82084531
butane;1-ethyl-4-methylpiperazine
CID 143179774
ethane;1-ethyl-4-[2-(4-methylpiperazin-1-yl)ethyl]piperazine
CID 170586549
ethane;1-ethyl-4-methylpiperazine;methanethiol
CID 142272147
acetaldehyde;1-ethyl-4-methylpiperazine
CID 143528036
1,4,7,10,13,16-hexaethyl-1,4,7,10,13,16-hexazacyclooctadecane
CID 66730221
1-ethyl-4,7-dimethyl-10-(2-methylpropyl)-1,4,7,10-tetrazacyclododecane
CID 118545612
1-ethyl-4-(2-methylpropyl)piperazine;1-methyl-4-(2-methylpropyl)piperazine
CID 165044772
1,4-diethylpiperazine;sulfane
CID 177062456
1,4-diethylpiperidine;1-ethyl-4-methylpiperazine
CID 143157970
2-(4-ethyl-7-methyl-1,4,7-triazonan-1-yl)acetic acid
CID 159982673
2-[7-(carboxymethyl)-4-ethyl-10-methyl-1,4,7,10-tetrazacyclododec-1-yl]acetic acid
CID 137448382

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine?
The IUPAC name of 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine (CID 160568928) is 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine.
What is the SMILES notation for 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine?
The canonical SMILES for 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine is CCN1CCN(C)CC1.CN1CCN(C)CC1.
What is the InChIKey of 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine?
The InChIKey is RAHIRQQEHDVXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2.C6H14N2/c1-3-9-6-4-8(2)5-7-9;1-7-3-5-8(2)6-4-7/h3-7H2,1-2H3;3-6H2,1-2H3.
What are the key properties of 1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine?
1,4-dimethylpiperazine;1-ethyl-4-methylpiperazine has a molecular weight of 242.41 g/mol, XLogP of 0.12, 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-ethyl-4-methylpiperazine is sourced from PubChem (CID 160568928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).