1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine

C17H24N2 — CID 70253087

IUPAC1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine
SMILESCCN(CC)C(C)c1cccc2cc(C)c(C)nc12
InChIInChI=1S/C17H24N2/c1-6-19(7-2)14(5)16-10-8-9-15-11-12(3)13(4)18-17(15)16/h8-11,14H,6-7H2,1-5H3
InChIKeySJLBKSQXMGGPGP-UHFFFAOYSA-N
MW256.39 g/mol
LogP4.25
Rot. Bonds4

About 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine

1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine (PubChem CID 70253087) has the molecular formula C17H24N2 and a molecular weight of 256.39 g/mol. Its IUPAC name is 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine.

Molecular Properties

Compound Name1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine
PubChem CID70253087
Molecular FormulaC17H24N2
Molecular Weight256.39 g/mol
Exact Mass256.19
IUPAC Name1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine
SMILESCCN(CC)C(C)c1cccc2cc(C)c(C)nc12
InChIInChI=1S/C17H24N2/c1-6-19(7-2)14(5)16-10-8-9-15-11-12(3)13(4)18-17(15)16/h8-11,14H,6-7H2,1-5H3
InChIKeySJLBKSQXMGGPGP-UHFFFAOYSA-N
XLogP4.25
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.39
LogP ≤ 54.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine?
The IUPAC name of 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine (CID 70253087) is 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine.
What is the SMILES notation for 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine?
The canonical SMILES for 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine is CCN(CC)C(C)c1cccc2cc(C)c(C)nc12.
What is the InChIKey of 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine?
The InChIKey is SJLBKSQXMGGPGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2/c1-6-19(7-2)14(5)16-10-8-9-15-11-12(3)13(4)18-17(15)16/h8-11,14H,6-7H2,1-5H3.
What are the key properties of 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine?
1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine has a molecular weight of 256.39 g/mol, XLogP of 4.25, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dimethylquinolin-8-yl)-N,N-diethylethanamine is sourced from PubChem (CID 70253087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).