2-di(propan-2-yl)alumanyl-N,N-dimethylaniline

C14H24AlN — CID 139777274

IUPAC2-di(propan-2-yl)alumanyl-N,N-dimethylaniline
SMILESCC(C)[Al](c1ccccc1N(C)C)C(C)C
InChIInChI=1S/C8H10N.2C3H7.Al/c1-9(2)8-6-4-3-5-7-8;2*1-3-2;/h3-6H,1-2H3;2*3H,1-2H3;
InChIKeyUKJHZMCLGLNJGV-UHFFFAOYSA-N
MW233.34 g/mol
LogP3.27
Rot. Bonds4

About 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline

2-di(propan-2-yl)alumanyl-N,N-dimethylaniline (PubChem CID 139777274) has the molecular formula C14H24AlN and a molecular weight of 233.34 g/mol. Its IUPAC name is 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline.

Molecular Properties

Compound Name2-di(propan-2-yl)alumanyl-N,N-dimethylaniline
PubChem CID139777274
Molecular FormulaC14H24AlN
Molecular Weight233.34 g/mol
Exact Mass233.17
IUPAC Name2-di(propan-2-yl)alumanyl-N,N-dimethylaniline
SMILESCC(C)[Al](c1ccccc1N(C)C)C(C)C
InChIInChI=1S/C8H10N.2C3H7.Al/c1-9(2)8-6-4-3-5-7-8;2*1-3-2;/h3-6H,1-2H3;2*3H,1-2H3;
InChIKeyUKJHZMCLGLNJGV-UHFFFAOYSA-N
XLogP3.27
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.34
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline?
The IUPAC name of 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline (CID 139777274) is 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline.
What is the SMILES notation for 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline?
The canonical SMILES for 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline is CC(C)[Al](c1ccccc1N(C)C)C(C)C.
What is the InChIKey of 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline?
The InChIKey is UKJHZMCLGLNJGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N.2C3H7.Al/c1-9(2)8-6-4-3-5-7-8;2*1-3-2;/h3-6H,1-2H3;2*3H,1-2H3;.
What are the key properties of 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline?
2-di(propan-2-yl)alumanyl-N,N-dimethylaniline has a molecular weight of 233.34 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-di(propan-2-yl)alumanyl-N,N-dimethylaniline is sourced from PubChem (CID 139777274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).