N-dimethylalumanyl-N-methylquinolin-8-amine

C12H15AlN2 — CID 21014579

IUPACN-dimethylalumanyl-N-methylquinolin-8-amine
SMILESCN(c1cccc2cccnc12)[Al](C)C
InChIInChI=1S/C10H9N2.2CH3.Al/c1-11-9-6-2-4-8-5-3-7-12-10(8)9;;;/h2-7H,1H3;2*1H3;/q-1;;;+1
InChIKeyIUXNVSNJUAYEKG-UHFFFAOYSA-N
MW214.25 g/mol
LogP2.92
Rot. Bonds2

About N-dimethylalumanyl-N-methylquinolin-8-amine

N-dimethylalumanyl-N-methylquinolin-8-amine (PubChem CID 21014579) has the molecular formula C12H15AlN2 and a molecular weight of 214.25 g/mol. Its IUPAC name is N-dimethylalumanyl-N-methylquinolin-8-amine.

Molecular Properties

Compound NameN-dimethylalumanyl-N-methylquinolin-8-amine
PubChem CID21014579
Molecular FormulaC12H15AlN2
Molecular Weight214.25 g/mol
Exact Mass214.11
IUPAC NameN-dimethylalumanyl-N-methylquinolin-8-amine
SMILESCN(c1cccc2cccnc12)[Al](C)C
InChIInChI=1S/C10H9N2.2CH3.Al/c1-11-9-6-2-4-8-5-3-7-12-10(8)9;;;/h2-7H,1H3;2*1H3;/q-1;;;+1
InChIKeyIUXNVSNJUAYEKG-UHFFFAOYSA-N
XLogP2.92
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.25
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-dimethylalumanyl-N-methylquinolin-8-amine?
The IUPAC name of N-dimethylalumanyl-N-methylquinolin-8-amine (CID 21014579) is N-dimethylalumanyl-N-methylquinolin-8-amine.
What is the SMILES notation for N-dimethylalumanyl-N-methylquinolin-8-amine?
The canonical SMILES for N-dimethylalumanyl-N-methylquinolin-8-amine is CN(c1cccc2cccnc12)[Al](C)C.
What is the InChIKey of N-dimethylalumanyl-N-methylquinolin-8-amine?
The InChIKey is IUXNVSNJUAYEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N2.2CH3.Al/c1-11-9-6-2-4-8-5-3-7-12-10(8)9;;;/h2-7H,1H3;2*1H3;/q-1;;;+1.
What are the key properties of N-dimethylalumanyl-N-methylquinolin-8-amine?
N-dimethylalumanyl-N-methylquinolin-8-amine has a molecular weight of 214.25 g/mol, XLogP of 2.92, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-dimethylalumanyl-N-methylquinolin-8-amine is sourced from PubChem (CID 21014579), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).