N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine

C17H23N3 — CID 63232032

IUPACN-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine
SMILESCCNc1nc2ccc(N3CCCCC3)cc2cc1C
InChIInChI=1S/C17H23N3/c1-3-18-17-13(2)11-14-12-15(7-8-16(14)19-17)20-9-5-4-6-10-20/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,18,19)
InChIKeyGDNXBRFVWKRMIM-UHFFFAOYSA-N
MW269.39 g/mol
LogP3.97
Rot. Bonds3

About N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine

N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine (PubChem CID 63232032) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine.

Molecular Properties

Compound NameN-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine
PubChem CID63232032
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC NameN-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine
SMILESCCNc1nc2ccc(N3CCCCC3)cc2cc1C
InChIInChI=1S/C17H23N3/c1-3-18-17-13(2)11-14-12-15(7-8-16(14)19-17)20-9-5-4-6-10-20/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,18,19)
InChIKeyGDNXBRFVWKRMIM-UHFFFAOYSA-N
XLogP3.97
TPSA28.16 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 ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine?
The IUPAC name of N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine (CID 63232032) is N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine.
What is the SMILES notation for N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine?
The canonical SMILES for N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine is CCNc1nc2ccc(N3CCCCC3)cc2cc1C.
What is the InChIKey of N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine?
The InChIKey is GDNXBRFVWKRMIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3/c1-3-18-17-13(2)11-14-12-15(7-8-16(14)19-17)20-9-5-4-6-10-20/h7-8,11-12H,3-6,9-10H2,1-2H3,(H,18,19).
What are the key properties of N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine?
N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine has a molecular weight of 269.39 g/mol, XLogP of 3.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3-methyl-6-piperidin-1-ylquinolin-2-amine is sourced from PubChem (CID 63232032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).