[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine

C17H23N3 — CID 62285192

IUPAC[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine
SMILESCCC1CCN(c2cc(CN)c3ccccc3n2)CC1
InChIInChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)17-11-14(12-18)15-5-3-4-6-16(15)19-17/h3-6,11,13H,2,7-10,12,18H2,1H3
InChIKeyDMOARZKSDJFZOE-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.32
Rot. Bonds3

About [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine

[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine (PubChem CID 62285192) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine.

Molecular Properties

Compound Name[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine
PubChem CID62285192
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine
SMILESCCC1CCN(c2cc(CN)c3ccccc3n2)CC1
InChIInChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)17-11-14(12-18)15-5-3-4-6-16(15)19-17/h3-6,11,13H,2,7-10,12,18H2,1H3
InChIKeyDMOARZKSDJFZOE-UHFFFAOYSA-N
XLogP3.32
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine?
The IUPAC name of [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine (CID 62285192) is [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine.
What is the SMILES notation for [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine?
The canonical SMILES for [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine is CCC1CCN(c2cc(CN)c3ccccc3n2)CC1.
What is the InChIKey of [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine?
The InChIKey is DMOARZKSDJFZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-2-13-7-9-20(10-8-13)17-11-14(12-18)15-5-3-4-6-16(15)19-17/h3-6,11,13H,2,7-10,12,18H2,1H3.
What are the key properties of [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine?
[2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine has a molecular weight of 269.39 g/mol, XLogP of 3.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-ethylpiperidin-1-yl)quinolin-4-yl]methanamine is sourced from PubChem (CID 62285192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).