1,3-dimethylpiperazine;ethane

C10H26N2 — CID 167500512

IUPAC1,3-dimethylpiperazine;ethane
SMILESCC.CC.CC1CN(C)CCN1
InChIInChI=1S/C6H14N2.2C2H6/c1-6-5-8(2)4-3-7-6;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3
InChIKeyFAOUGQQAJPEXLJ-UHFFFAOYSA-N
MW174.33 g/mol
LogP1.96
Rot. Bonds

About 1,3-dimethylpiperazine;ethane

1,3-dimethylpiperazine;ethane (PubChem CID 167500512) has the molecular formula C10H26N2 and a molecular weight of 174.33 g/mol. Its IUPAC name is 1,3-dimethylpiperazine;ethane.

Molecular Properties

Compound Name1,3-dimethylpiperazine;ethane
PubChem CID167500512
Molecular FormulaC10H26N2
Molecular Weight174.33 g/mol
Exact Mass174.21
IUPAC Name1,3-dimethylpiperazine;ethane
SMILESCC.CC.CC1CN(C)CCN1
InChIInChI=1S/C6H14N2.2C2H6/c1-6-5-8(2)4-3-7-6;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3
InChIKeyFAOUGQQAJPEXLJ-UHFFFAOYSA-N
XLogP1.96
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.33
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3R)-1,3-dimethylpiperazine;ethane
CID 143846249
(3R)-1,3-dimethylpiperazine;molecular hydrogen
CID 145424168
1,3-dimethylpiperazine;piperazine;hydrochloride
CID 174960389
(3R)-3-methyl-1-(trideuteriomethyl)piperazine
CID 165429760
(5S)-1,5-dimethyl-1,4-diazepane
CID 93492381
(3R)-3-(fluoromethyl)-1-methylpiperazine
CID 67523011
3-ethyl-1-methylpiperazine;hydrochloride
CID 138111979
1-(4-methylpiperazin-2-yl)ethanamine
CID 116941341
3-methyl-1-(2-pyrrolidin-1-ylethyl)piperazine
CID 65448835
1-cyclopropyl-3-methylpiperazine
CID 64926788
4-methyl-2,3,5,5a,6,7,8,8a-octahydro-1H-cyclopenta[e][1,4]diazepine
CID 82416478
N,N-diethyl-2-(4-methylpiperazin-2-yl)ethanamine
CID 83619171

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethylpiperazine;ethane?
The IUPAC name of 1,3-dimethylpiperazine;ethane (CID 167500512) is 1,3-dimethylpiperazine;ethane.
What is the SMILES notation for 1,3-dimethylpiperazine;ethane?
The canonical SMILES for 1,3-dimethylpiperazine;ethane is CC.CC.CC1CN(C)CCN1.
What is the InChIKey of 1,3-dimethylpiperazine;ethane?
The InChIKey is FAOUGQQAJPEXLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2.2C2H6/c1-6-5-8(2)4-3-7-6;2*1-2/h6-7H,3-5H2,1-2H3;2*1-2H3.
What are the key properties of 1,3-dimethylpiperazine;ethane?
1,3-dimethylpiperazine;ethane has a molecular weight of 174.33 g/mol, XLogP of 1.96, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethylpiperazine;ethane is sourced from PubChem (CID 167500512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).