2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine

C12H16N2 — CID 143299726

IUPAC2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine
SMILESCc1cccc2c1NCC=C2CCN
InChIInChI=1S/C12H16N2/c1-9-3-2-4-11-10(5-7-13)6-8-14-12(9)11/h2-4,6,14H,5,7-8,13H2,1H3
InChIKeySWVAKMIEHUQETR-UHFFFAOYSA-N
MW188.27 g/mol
LogP2.15
Rot. Bonds2

About 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine

2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine (PubChem CID 143299726) has the molecular formula C12H16N2 and a molecular weight of 188.27 g/mol. Its IUPAC name is 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine.

Molecular Properties

Compound Name2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine
PubChem CID143299726
Molecular FormulaC12H16N2
Molecular Weight188.27 g/mol
Exact Mass188.13
IUPAC Name2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine
SMILESCc1cccc2c1NCC=C2CCN
InChIInChI=1S/C12H16N2/c1-9-3-2-4-11-10(5-7-13)6-8-14-12(9)11/h2-4,6,14H,5,7-8,13H2,1H3
InChIKeySWVAKMIEHUQETR-UHFFFAOYSA-N
XLogP2.15
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine?
The IUPAC name of 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine (CID 143299726) is 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine.
What is the SMILES notation for 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine?
The canonical SMILES for 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine is Cc1cccc2c1NCC=C2CCN.
What is the InChIKey of 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine?
The InChIKey is SWVAKMIEHUQETR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2/c1-9-3-2-4-11-10(5-7-13)6-8-14-12(9)11/h2-4,6,14H,5,7-8,13H2,1H3.
What are the key properties of 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine?
2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine has a molecular weight of 188.27 g/mol, XLogP of 2.15, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-methyl-1,2-dihydroquinolin-4-yl)ethanamine is sourced from PubChem (CID 143299726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).