2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine

C15H20N2 — CID 84625527

IUPAC2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine
SMILESCc1cc2cccc(C)c2nc1C(C)(C)CN
InChIInChI=1S/C15H20N2/c1-10-6-5-7-12-8-11(2)14(17-13(10)12)15(3,4)9-16/h5-8H,9,16H2,1-4H3
InChIKeyICCNLZBYYAMATE-UHFFFAOYSA-N
MW228.34 g/mol
LogP3.09
Rot. Bonds2

About 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine

2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine (PubChem CID 84625527) has the molecular formula C15H20N2 and a molecular weight of 228.34 g/mol. Its IUPAC name is 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine
PubChem CID84625527
Molecular FormulaC15H20N2
Molecular Weight228.34 g/mol
Exact Mass228.16
IUPAC Name2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine
SMILESCc1cc2cccc(C)c2nc1C(C)(C)CN
InChIInChI=1S/C15H20N2/c1-10-6-5-7-12-8-11(2)14(17-13(10)12)15(3,4)9-16/h5-8H,9,16H2,1-4H3
InChIKeyICCNLZBYYAMATE-UHFFFAOYSA-N
XLogP3.09
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine (CID 84625527) is 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine is Cc1cc2cccc(C)c2nc1C(C)(C)CN.
What is the InChIKey of 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine?
The InChIKey is ICCNLZBYYAMATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2/c1-10-6-5-7-12-8-11(2)14(17-13(10)12)15(3,4)9-16/h5-8H,9,16H2,1-4H3.
What are the key properties of 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine?
2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine has a molecular weight of 228.34 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,8-dimethylquinolin-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 84625527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).