N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine

C19H24N2 — CID 43281288

IUPACN-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1N1CCCc2cc(C)ccc21
InChIInChI=1S/C19H24N2/c1-3-20-14-17-7-4-5-9-18(17)21-12-6-8-16-13-15(2)10-11-19(16)21/h4-5,7,9-11,13,20H,3,6,8,12,14H2,1-2H3
InChIKeyRYULFHCDHWRQSR-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.19
Rot. Bonds4

About N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine

N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine (PubChem CID 43281288) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine
PubChem CID43281288
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine
SMILESCCNCc1ccccc1N1CCCc2cc(C)ccc21
InChIInChI=1S/C19H24N2/c1-3-20-14-17-7-4-5-9-18(17)21-12-6-8-16-13-15(2)10-11-19(16)21/h4-5,7,9-11,13,20H,3,6,8,12,14H2,1-2H3
InChIKeyRYULFHCDHWRQSR-UHFFFAOYSA-N
XLogP4.19
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine?
The IUPAC name of N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine (CID 43281288) is N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine.
What is the SMILES notation for N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine?
The canonical SMILES for N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine is CCNCc1ccccc1N1CCCc2cc(C)ccc21.
What is the InChIKey of N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine?
The InChIKey is RYULFHCDHWRQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-3-20-14-17-7-4-5-9-18(17)21-12-6-8-16-13-15(2)10-11-19(16)21/h4-5,7,9-11,13,20H,3,6,8,12,14H2,1-2H3.
What are the key properties of N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine?
N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine has a molecular weight of 280.42 g/mol, XLogP of 4.19, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(6-methyl-3,4-dihydro-2H-quinolin-1-yl)phenyl]methyl]ethanamine is sourced from PubChem (CID 43281288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).