bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane

C15H26AlN — CID 145373362

IUPACbis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane
SMILESCc1cccc(C[Al](CC(C)C)CC(C)C)n1
InChIInChI=1S/C7H8N.2C4H9.Al/c1-6-4-3-5-7(2)8-6;2*1-4(2)3;/h3-5H,1H2,2H3;2*4H,1H2,2-3H3;
InChIKeyCDYOOJWGPBQVGY-UHFFFAOYSA-N
MW247.36 g/mol
LogP4.28
Rot. Bonds6

About bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane

bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane (PubChem CID 145373362) has the molecular formula C15H26AlN and a molecular weight of 247.36 g/mol. Its IUPAC name is bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane.

Molecular Properties

Compound Namebis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane
PubChem CID145373362
Molecular FormulaC15H26AlN
Molecular Weight247.36 g/mol
Exact Mass247.19
IUPAC Namebis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane
SMILESCc1cccc(C[Al](CC(C)C)CC(C)C)n1
InChIInChI=1S/C7H8N.2C4H9.Al/c1-6-4-3-5-7(2)8-6;2*1-4(2)3;/h3-5H,1H2,2H3;2*4H,1H2,2-3H3;
InChIKeyCDYOOJWGPBQVGY-UHFFFAOYSA-N
XLogP4.28
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.36
LogP ≤ 54.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-methylpropoxy)-1-(6-methyl-2-pyridinyl)methanamine
CID 82714626
2-methyl-N-[(6-methyl-2-pyridinyl)methyl]-N-propan-2-ylpropan-1-amine
CID 23588532
(2S)-1-(6-methyl-2-pyridinyl)propane-2-sulfonamide
CID 145191448
N-methyl-1-(6-methyl-2-pyridinyl)propan-2-amine
CID 16640577
ethane;(6-methyl-2-pyridinyl)methanol
CID 123372592
(6-methyl-2-pyridinyl)methanol;hydrochloride
CID 18413908
1-(6-methyl-2-pyridinyl)-N-[(6-methyl-2-pyridinyl)methyl]methanamine
CID 15491901
2-(2-fluoroethyl)-6-methylpyridine
CID 70660766
3,3-dimethyl-N-[(6-methyl-2-pyridinyl)methyl]butan-2-amine
CID 115710700
1-(6-methyl-2-pyridinyl)butan-2-ol
CID 63200949
2-methyl-6-(2-methylpropyl)pyridine;3-(2-methylpropyl)pyridine
CID 158328245
2-chloro-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]propan-1-amine
CID 79260632

Frequently Asked Questions

What is the IUPAC name of bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane?
The IUPAC name of bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane (CID 145373362) is bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane.
What is the SMILES notation for bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane?
The canonical SMILES for bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane is Cc1cccc(C[Al](CC(C)C)CC(C)C)n1.
What is the InChIKey of bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane?
The InChIKey is CDYOOJWGPBQVGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N.2C4H9.Al/c1-6-4-3-5-7(2)8-6;2*1-4(2)3;/h3-5H,1H2,2H3;2*4H,1H2,2-3H3;.
What are the key properties of bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane?
bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane has a molecular weight of 247.36 g/mol, XLogP of 4.28, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methylpropyl)-[(6-methyl-2-pyridinyl)methyl]alumane is sourced from PubChem (CID 145373362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).