N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine

C11H29AlN4 — CID 140683981

IUPACN'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine
SMILESCCN(C)[Al](N(C)CC)N(C)CCN(C)C
InChIInChI=1S/C5H13N2.2C3H8N.Al/c1-6-4-5-7(2)3;2*1-3-4-2;/h4-5H2,1-3H3;2*3H2,1-2H3;/q3*-1;+3
InChIKeyRUBUBXMTZMGGCE-UHFFFAOYSA-N
MW244.36 g/mol
LogP0.37
Rot. Bonds8

About N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine

N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine (PubChem CID 140683981) has the molecular formula C11H29AlN4 and a molecular weight of 244.36 g/mol. Its IUPAC name is N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine
PubChem CID140683981
Molecular FormulaC11H29AlN4
Molecular Weight244.36 g/mol
Exact Mass244.22
IUPAC NameN'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine
SMILESCCN(C)[Al](N(C)CC)N(C)CCN(C)C
InChIInChI=1S/C5H13N2.2C3H8N.Al/c1-6-4-5-7(2)3;2*1-3-4-2;/h4-5H2,1-3H3;2*3H2,1-2H3;/q3*-1;+3
InChIKeyRUBUBXMTZMGGCE-UHFFFAOYSA-N
XLogP0.37
TPSA12.96 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.36
LogP ≤ 50.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine?
The IUPAC name of N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine (CID 140683981) is N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine.
What is the SMILES notation for N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine?
The canonical SMILES for N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine is CCN(C)[Al](N(C)CC)N(C)CCN(C)C.
What is the InChIKey of N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine?
The InChIKey is RUBUBXMTZMGGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N2.2C3H8N.Al/c1-6-4-5-7(2)3;2*1-3-4-2;/h4-5H2,1-3H3;2*3H2,1-2H3;/q3*-1;+3.
What are the key properties of N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine?
N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine has a molecular weight of 244.36 g/mol, XLogP of 0.37, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-bis[ethyl(methyl)amino]alumanyl-N,N,N'-trimethylethane-1,2-diamine is sourced from PubChem (CID 140683981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).