2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine

C12H18N2 — CID 84618930

IUPAC2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
SMILESCN1c2ccccc2CCC1CCN
InChIInChI=1S/C12H18N2/c1-14-11(8-9-13)7-6-10-4-2-3-5-12(10)14/h2-5,11H,6-9,13H2,1H3
InChIKeyLLUOVFKSHIKMMD-UHFFFAOYSA-N
MW190.29 g/mol
LogP1.79
Rot. Bonds2

About 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine

2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine (PubChem CID 84618930) has the molecular formula C12H18N2 and a molecular weight of 190.29 g/mol. Its IUPAC name is 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine.

Molecular Properties

Compound Name2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
PubChem CID84618930
Molecular FormulaC12H18N2
Molecular Weight190.29 g/mol
Exact Mass190.15
IUPAC Name2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine
SMILESCN1c2ccccc2CCC1CCN
InChIInChI=1S/C12H18N2/c1-14-11(8-9-13)7-6-10-4-2-3-5-12(10)14/h2-5,11H,6-9,13H2,1H3
InChIKeyLLUOVFKSHIKMMD-UHFFFAOYSA-N
XLogP1.79
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine?
The IUPAC name of 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine (CID 84618930) is 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine.
What is the SMILES notation for 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine?
The canonical SMILES for 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine is CN1c2ccccc2CCC1CCN.
What is the InChIKey of 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine?
The InChIKey is LLUOVFKSHIKMMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2/c1-14-11(8-9-13)7-6-10-4-2-3-5-12(10)14/h2-5,11H,6-9,13H2,1H3.
What are the key properties of 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine?
2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine has a molecular weight of 190.29 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methyl-3,4-dihydro-2H-quinolin-2-yl)ethanamine is sourced from PubChem (CID 84618930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).