2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium

C9H24N3+ — CID 12973779

IUPAC2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium
SMILESCN(C)CCN(C)CC[NH+](C)C
InChIInChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3/p+1
InChIKeyUKODFQOELJFMII-UHFFFAOYSA-O
MW174.31 g/mol
LogP-1.38
Rot. Bonds6

About 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium

2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium (PubChem CID 12973779) has the molecular formula C9H24N3+ and a molecular weight of 174.31 g/mol. Its IUPAC name is 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium.

Molecular Properties

Compound Name2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium
PubChem CID12973779
Molecular FormulaC9H24N3+
Molecular Weight174.31 g/mol
Exact Mass174.20
IUPAC Name2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium
SMILESCN(C)CCN(C)CC[NH+](C)C
InChIInChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3/p+1
InChIKeyUKODFQOELJFMII-UHFFFAOYSA-O
XLogP-1.38
TPSA10.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.31
LogP ≤ 5-1.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N',N'-bis[2-(dimethylamino)ethyl]-N,N-dimethylethane-1,2-diamine;N'-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]-N,N,N'-trimethylethane-1,2-diamine;N'-[2-(dimethylamino)ethyl]-N,N,N'-trimethylethane-1,2-diamine;N,N,N',N'-tetramethylethane-1,2-diamine
CID 163585742
N,N'-bis[2-(dimethylamino)ethyl]-N,N'-dimethylpropane-1,3-diamine
CID 547219
dichlorocopper;N'-[2-(dimethylamino)ethyl]-N,N,N'-trimethylethane-1,2-diamine
CID 15303380
propane;N,N,N'-trimethyl-N'-propylethane-1,2-diamine
CID 144610913
N'-[2-[2-(dimethylamino)ethyl-methylamino]ethyl]-N'-methylethane-1,2-diamine;N'-[2-(dimethylamino)ethyl]-N'-methylethane-1,2-diamine
CID 23499637
[2-(dimethylamino)ethyl-methylamino]methanol;ethane
CID 145172479
CID 88826921
CID 88826921
CID 173338058
CID 173338058
CID 175787026
CID 175787026
iron(5+);N,N,N',N'-tetramethylethane-1,2-diamine;pentacyanide
CID 88790410
N'-[2-[tert-butyl(methyl)amino]ethyl]-N,N,N'-trimethylethane-1,2-diamine
CID 158891423
copper;bis(N,N,N',N'-tetramethylethane-1,2-diamine);dihydrochloride
CID 173046939

Frequently Asked Questions

What is the IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium?
The IUPAC name of 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium (CID 12973779) is 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium.
What is the SMILES notation for 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium?
The canonical SMILES for 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium is CN(C)CCN(C)CC[NH+](C)C.
What is the InChIKey of 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium?
The InChIKey is UKODFQOELJFMII-UHFFFAOYSA-O. The full InChI is InChI=1S/C9H23N3/c1-10(2)6-8-12(5)9-7-11(3)4/h6-9H2,1-5H3/p+1.
What are the key properties of 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium?
2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium has a molecular weight of 174.31 g/mol, XLogP of -1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(dimethylamino)ethyl-methylamino]ethyl-dimethylazanium is sourced from PubChem (CID 12973779), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).