1-benzyl-2,4-dimethylpiperazine;ethane

C17H32N2 — CID 145145723

IUPAC1-benzyl-2,4-dimethylpiperazine;ethane
SMILESCC.CC.CC1CN(C)CCN1Cc1ccccc1
InChIInChI=1S/C13H20N2.2C2H6/c1-12-10-14(2)8-9-15(12)11-13-6-4-3-5-7-13;2*1-2/h3-7,12H,8-11H2,1-2H3;2*1-2H3
InChIKeyMFKVMLYNANLSAE-UHFFFAOYSA-N
MW264.46 g/mol
LogP3.87
Rot. Bonds2

About 1-benzyl-2,4-dimethylpiperazine;ethane

1-benzyl-2,4-dimethylpiperazine;ethane (PubChem CID 145145723) has the molecular formula C17H32N2 and a molecular weight of 264.46 g/mol. Its IUPAC name is 1-benzyl-2,4-dimethylpiperazine;ethane.

Molecular Properties

Compound Name1-benzyl-2,4-dimethylpiperazine;ethane
PubChem CID145145723
Molecular FormulaC17H32N2
Molecular Weight264.46 g/mol
Exact Mass264.26
IUPAC Name1-benzyl-2,4-dimethylpiperazine;ethane
SMILESCC.CC.CC1CN(C)CCN1Cc1ccccc1
InChIInChI=1S/C13H20N2.2C2H6/c1-12-10-14(2)8-9-15(12)11-13-6-4-3-5-7-13;2*1-2/h3-7,12H,8-11H2,1-2H3;2*1-2H3
InChIKeyMFKVMLYNANLSAE-UHFFFAOYSA-N
XLogP3.87
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.46
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4,11-dibenzyl-1,5,8,12-tetramethyl-1,4,8,11-tetrazacyclotetradecane
CID 101436229
1-benzyl-2,4,6-trimethylpiperazine;ethane
CID 145145850
3-[(2,4-dimethylpiperazin-1-yl)methyl]benzonitrile
CID 71877621
1-benzyl-2,4,5-trimethylpiperazine
CID 72621990
(4-benzyl-3-methylpiperazin-1-yl)-phenylmethanone
CID 10803751
5-[[(2S)-2,4-dimethylpiperazin-1-yl]methyl]pyridin-2-amine
CID 134555297
4-benzyl-2-methyl-1,4-diazabicyclo[3.2.2]nonane
CID 130838279
2-(4-benzyl-3-methylpiperazin-1-yl)ethanethioamide
CID 131226911
(4S)-1-benzyl-2,4-dimethylpyrrolidine
CID 118651465
(2S,4R)-1-benzyl-2,4-dimethylpyrrolidine
CID 15316822
4-benzyl-N-tert-butyl-3-methylpiperazine-1-carboxamide
CID 70933120
2-[[(2S)-2,4-dimethylpiperazin-1-yl]methyl]-1,3-benzoxazole
CID 67987635

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2,4-dimethylpiperazine;ethane?
The IUPAC name of 1-benzyl-2,4-dimethylpiperazine;ethane (CID 145145723) is 1-benzyl-2,4-dimethylpiperazine;ethane.
What is the SMILES notation for 1-benzyl-2,4-dimethylpiperazine;ethane?
The canonical SMILES for 1-benzyl-2,4-dimethylpiperazine;ethane is CC.CC.CC1CN(C)CCN1Cc1ccccc1.
What is the InChIKey of 1-benzyl-2,4-dimethylpiperazine;ethane?
The InChIKey is MFKVMLYNANLSAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2.2C2H6/c1-12-10-14(2)8-9-15(12)11-13-6-4-3-5-7-13;2*1-2/h3-7,12H,8-11H2,1-2H3;2*1-2H3.
What are the key properties of 1-benzyl-2,4-dimethylpiperazine;ethane?
1-benzyl-2,4-dimethylpiperazine;ethane has a molecular weight of 264.46 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2,4-dimethylpiperazine;ethane is sourced from PubChem (CID 145145723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).