N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine

C8H21AlN2O — CID 156656265

IUPACN-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine
SMILESCN(C)CCOCCCN(C)[AlH2]
InChIInChI=1S/C8H19N2O.Al.2H/c1-9-5-4-7-11-8-6-10(2)3;;;/h4-8H2,1-3H3;;;/q-1;+1;;
InChIKeyYIKNUXSHEQWMEQ-UHFFFAOYSA-N
MW188.25 g/mol
LogP-0.57
Rot. Bonds7

About N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine

N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine (PubChem CID 156656265) has the molecular formula C8H21AlN2O and a molecular weight of 188.25 g/mol. Its IUPAC name is N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine.

Molecular Properties

Compound NameN-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine
PubChem CID156656265
Molecular FormulaC8H21AlN2O
Molecular Weight188.25 g/mol
Exact Mass188.15
IUPAC NameN-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine
SMILESCN(C)CCOCCCN(C)[AlH2]
InChIInChI=1S/C8H19N2O.Al.2H/c1-9-5-4-7-11-8-6-10(2)3;;;/h4-8H2,1-3H3;;;/q-1;+1;;
InChIKeyYIKNUXSHEQWMEQ-UHFFFAOYSA-N
XLogP-0.57
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.25
LogP ≤ 5-0.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(3-alumanyloxypropoxy)-N,N-dimethylethanamine
CID 156656248
2-[2-[2-(dimethylamino)ethoxy]ethoxy]-N,N-dimethylethanamine;ethane
CID 168987783
6-[3-(dimethylamino)propoxy]-N,N-dimethylhexan-1-amine
CID 71335921
potassium 2-[2-[3-(dimethylamino)propoxy]ethoxy]ethanolate
CID 159366457
5-[10-[5-(dimethylamino)pentoxy]decoxy]-N,N-dimethylpentan-1-amine
CID 154134188
2-[2-(dimethylamino)ethoxy]ethanolate
CID 23295259
3-(2-aminoethoxy)-N,N-dimethylpropan-1-amine
CID 56993773
2-[2-(dimethylamino)ethoxy]ethanol
CID 158737336
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 154730088
2-[2-[2-(dimethylamino)ethoxy]ethoxy]ethanamine
CID 58108235
2-[2-(dimethylamino)ethoxy]ethyl hypoiodite
CID 138660148
2-(2-chloroethoxy)-N,N-dimethylethanamine;hydrochloride
CID 71756551

Frequently Asked Questions

What is the IUPAC name of N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine?
The IUPAC name of N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine (CID 156656265) is N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine.
What is the SMILES notation for N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine?
The canonical SMILES for N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine is CN(C)CCOCCCN(C)[AlH2].
What is the InChIKey of N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine?
The InChIKey is YIKNUXSHEQWMEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N2O.Al.2H/c1-9-5-4-7-11-8-6-10(2)3;;;/h4-8H2,1-3H3;;;/q-1;+1;;.
What are the key properties of N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine?
N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine has a molecular weight of 188.25 g/mol, XLogP of -0.57, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-alumanyl-3-[2-(dimethylamino)ethoxy]-N-methylpropan-1-amine is sourced from PubChem (CID 156656265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).