N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine

C17H23N3 — CID 79549224

IUPACN-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine
SMILESCC(CC1CCCCN1)Nc1cccc2cccnc12
InChIInChI=1S/C17H23N3/c1-13(12-15-8-2-3-10-18-15)20-16-9-4-6-14-7-5-11-19-17(14)16/h4-7,9,11,13,15,18,20H,2-3,8,10,12H2,1H3
InChIKeyVKDQWDWMQXDBGS-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.57
Rot. Bonds4

About N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine

N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine (PubChem CID 79549224) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine.

Molecular Properties

Compound NameN-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine
PubChem CID79549224
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine
SMILESCC(CC1CCCCN1)Nc1cccc2cccnc12
InChIInChI=1S/C17H23N3/c1-13(12-15-8-2-3-10-18-15)20-16-9-4-6-14-7-5-11-19-17(14)16/h4-7,9,11,13,15,18,20H,2-3,8,10,12H2,1H3
InChIKeyVKDQWDWMQXDBGS-UHFFFAOYSA-N
XLogP3.57
TPSA36.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine?
The IUPAC name of N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine (CID 79549224) is N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine.
What is the SMILES notation for N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine?
The canonical SMILES for N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine is CC(CC1CCCCN1)Nc1cccc2cccnc12.
What is the InChIKey of N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine?
The InChIKey is VKDQWDWMQXDBGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-13(12-15-8-2-3-10-18-15)20-16-9-4-6-14-7-5-11-19-17(14)16/h4-7,9,11,13,15,18,20H,2-3,8,10,12H2,1H3.
What are the key properties of N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine?
N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine has a molecular weight of 269.39 g/mol, XLogP of 3.57, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-piperidin-2-ylpropan-2-yl)quinolin-8-amine is sourced from PubChem (CID 79549224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).