1,4-dimethylpiperazine;ethane

C16H44N2 — CID 91292414

IUPAC1,4-dimethylpiperazine;ethane
SMILESCC.CC.CC.CC.CC.CN1CCN(C)CC1
InChIInChI=1S/C6H14N2.5C2H6/c1-7-3-5-8(2)6-4-7;5*1-2/h3-6H2,1-2H3;5*1-2H3
InChIKeyKJBDXJMAUQLWLV-UHFFFAOYSA-N
MW264.54 g/mol
LogP4.99
Rot. Bonds

About 1,4-dimethylpiperazine;ethane

1,4-dimethylpiperazine;ethane (PubChem CID 91292414) has the molecular formula C16H44N2 and a molecular weight of 264.54 g/mol. Its IUPAC name is 1,4-dimethylpiperazine;ethane.

Molecular Properties

Compound Name1,4-dimethylpiperazine;ethane
PubChem CID91292414
Molecular FormulaC16H44N2
Molecular Weight264.54 g/mol
Exact Mass264.35
IUPAC Name1,4-dimethylpiperazine;ethane
SMILESCC.CC.CC.CC.CC.CN1CCN(C)CC1
InChIInChI=1S/C6H14N2.5C2H6/c1-7-3-5-8(2)6-4-7;5*1-2/h3-6H2,1-2H3;5*1-2H3
InChIKeyKJBDXJMAUQLWLV-UHFFFAOYSA-N
XLogP4.99
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.54
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-dimethylpiperazine;ethane;1-methylpiperidine
CID 170707096
bis(1,4-dimethylpiperazine);ethane;tris(1-methylpiperidine)
CID 157233170
1,4-dimethyl-1,4-diazecane;ethane
CID 143609892
1,4,7-trimethyl-1,4,7-triazecane
CID 15461213
1,4,8,12-tetramethyl-1,4,8,12-tetrazacyclopentadecane
CID 15198794
ethane;bis(1-methylpyrrolidine)
CID 153385238
1,4-dimethylpiperazine;ethane;methane;1-methylpiperidine
CID 161204219
ethane;1-hydroxy-4-methylpiperazine
CID 142974106
1,3,6-trimethyl-1,3,6-triazecane
CID 154027654
ethane;1-methylazonane
CID 145157770
cyclohexane;cyclopentane;ethane;bis(1-methylpiperidine);bis(1-methylpyrrolidine)
CID 161378363
1,4-dimethylpiperazine;iron(5+);pentacyanide
CID 88790382

Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperazine;ethane?
The IUPAC name of 1,4-dimethylpiperazine;ethane (CID 91292414) is 1,4-dimethylpiperazine;ethane.
What is the SMILES notation for 1,4-dimethylpiperazine;ethane?
The canonical SMILES for 1,4-dimethylpiperazine;ethane is CC.CC.CC.CC.CC.CN1CCN(C)CC1.
What is the InChIKey of 1,4-dimethylpiperazine;ethane?
The InChIKey is KJBDXJMAUQLWLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2.5C2H6/c1-7-3-5-8(2)6-4-7;5*1-2/h3-6H2,1-2H3;5*1-2H3.
What are the key properties of 1,4-dimethylpiperazine;ethane?
1,4-dimethylpiperazine;ethane has a molecular weight of 264.54 g/mol, XLogP of 4.99, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperazine;ethane is sourced from PubChem (CID 91292414), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).