6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine

C16H21N3 — CID 43809501

IUPAC6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine
SMILESCC1CC(C)CN(c2ccc3ncccc3c2N)C1
InChIInChI=1S/C16H21N3/c1-11-8-12(2)10-19(9-11)15-6-5-14-13(16(15)17)4-3-7-18-14/h3-7,11-12H,8-10,17H2,1-2H3
InChIKeyMYLWGZIPRXBJEW-UHFFFAOYSA-N
MW255.37 g/mol
LogP3.30
Rot. Bonds1

About 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine

6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine (PubChem CID 43809501) has the molecular formula C16H21N3 and a molecular weight of 255.37 g/mol. Its IUPAC name is 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine.

Molecular Properties

Compound Name6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine
PubChem CID43809501
Molecular FormulaC16H21N3
Molecular Weight255.37 g/mol
Exact Mass255.17
IUPAC Name6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine
SMILESCC1CC(C)CN(c2ccc3ncccc3c2N)C1
InChIInChI=1S/C16H21N3/c1-11-8-12(2)10-19(9-11)15-6-5-14-13(16(15)17)4-3-7-18-14/h3-7,11-12H,8-10,17H2,1-2H3
InChIKeyMYLWGZIPRXBJEW-UHFFFAOYSA-N
XLogP3.30
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.37
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine?
The IUPAC name of 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine (CID 43809501) is 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine.
What is the SMILES notation for 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine?
The canonical SMILES for 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine is CC1CC(C)CN(c2ccc3ncccc3c2N)C1.
What is the InChIKey of 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine?
The InChIKey is MYLWGZIPRXBJEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3/c1-11-8-12(2)10-19(9-11)15-6-5-14-13(16(15)17)4-3-7-18-14/h3-7,11-12H,8-10,17H2,1-2H3.
What are the key properties of 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine?
6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine has a molecular weight of 255.37 g/mol, XLogP of 3.30, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,5-dimethylpiperidin-1-yl)quinolin-5-amine is sourced from PubChem (CID 43809501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).