1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine

C14H18N2O — CID 82575817

IUPAC1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine
SMILESCCOc1cccc2c(C(C)N)cc(C)nc12
InChIInChI=1S/C14H18N2O/c1-4-17-13-7-5-6-11-12(10(3)15)8-9(2)16-14(11)13/h5-8,10H,4,15H2,1-3H3
InChIKeyCYLUEOIGDULZSZ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.96
Rot. Bonds3

About 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine

1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine (PubChem CID 82575817) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine.

Molecular Properties

Compound Name1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine
PubChem CID82575817
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine
SMILESCCOc1cccc2c(C(C)N)cc(C)nc12
InChIInChI=1S/C14H18N2O/c1-4-17-13-7-5-6-11-12(10(3)15)8-9(2)16-14(11)13/h5-8,10H,4,15H2,1-3H3
InChIKeyCYLUEOIGDULZSZ-UHFFFAOYSA-N
XLogP2.96
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The IUPAC name of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine (CID 82575817) is 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine.
What is the SMILES notation for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The canonical SMILES for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine is CCOc1cccc2c(C(C)N)cc(C)nc12.
What is the InChIKey of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The InChIKey is CYLUEOIGDULZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-4-17-13-7-5-6-11-12(10(3)15)8-9(2)16-14(11)13/h5-8,10H,4,15H2,1-3H3.
What are the key properties of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine has a molecular weight of 230.31 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine is sourced from PubChem (CID 82575817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).