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

C15H24N2 — CID 102661914

IUPAC1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine
SMILESCC(C)CN1CCCc2cc(C(C)N)ccc21
InChIInChI=1S/C15H24N2/c1-11(2)10-17-8-4-5-14-9-13(12(3)16)6-7-15(14)17/h6-7,9,11-12H,4-5,8,10,16H2,1-3H3
InChIKeyVFQHSTXUZMJYCW-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.11
Rot. Bonds3

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

1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine (PubChem CID 102661914) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine.

Molecular Properties

Compound Name1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine
PubChem CID102661914
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine
SMILESCC(C)CN1CCCc2cc(C(C)N)ccc21
InChIInChI=1S/C15H24N2/c1-11(2)10-17-8-4-5-14-9-13(12(3)16)6-7-15(14)17/h6-7,9,11-12H,4-5,8,10,16H2,1-3H3
InChIKeyVFQHSTXUZMJYCW-UHFFFAOYSA-N
XLogP3.11
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine?
The IUPAC name of 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine (CID 102661914) is 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine.
What is the SMILES notation for 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine?
The canonical SMILES for 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine is CC(C)CN1CCCc2cc(C(C)N)ccc21.
What is the InChIKey of 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine?
The InChIKey is VFQHSTXUZMJYCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-11(2)10-17-8-4-5-14-9-13(12(3)16)6-7-15(14)17/h6-7,9,11-12H,4-5,8,10,16H2,1-3H3.
What are the key properties of 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine?
1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine has a molecular weight of 232.37 g/mol, XLogP of 3.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(2-methylpropyl)-3,4-dihydro-2H-quinolin-6-yl]ethanamine is sourced from PubChem (CID 102661914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).