2-ethoxy-N-methylquinolin-3-amine

C12H14N2O — CID 174800672

IUPAC2-ethoxy-N-methylquinolin-3-amine
SMILESCCOc1nc2ccccc2cc1NC
InChIInChI=1S/C12H14N2O/c1-3-15-12-11(13-2)8-9-6-4-5-7-10(9)14-12/h4-8,13H,3H2,1-2H3
InChIKeyQKSPGRLOTVTRIH-UHFFFAOYSA-N
MW202.26 g/mol
LogP2.68
Rot. Bonds3

About 2-ethoxy-N-methylquinolin-3-amine

2-ethoxy-N-methylquinolin-3-amine (PubChem CID 174800672) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-ethoxy-N-methylquinolin-3-amine.

Molecular Properties

Compound Name2-ethoxy-N-methylquinolin-3-amine
PubChem CID174800672
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-ethoxy-N-methylquinolin-3-amine
SMILESCCOc1nc2ccccc2cc1NC
InChIInChI=1S/C12H14N2O/c1-3-15-12-11(13-2)8-9-6-4-5-7-10(9)14-12/h4-8,13H,3H2,1-2H3
InChIKeyQKSPGRLOTVTRIH-UHFFFAOYSA-N
XLogP2.68
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-methylquinolin-3-amine?
The IUPAC name of 2-ethoxy-N-methylquinolin-3-amine (CID 174800672) is 2-ethoxy-N-methylquinolin-3-amine.
What is the SMILES notation for 2-ethoxy-N-methylquinolin-3-amine?
The canonical SMILES for 2-ethoxy-N-methylquinolin-3-amine is CCOc1nc2ccccc2cc1NC.
What is the InChIKey of 2-ethoxy-N-methylquinolin-3-amine?
The InChIKey is QKSPGRLOTVTRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-3-15-12-11(13-2)8-9-6-4-5-7-10(9)14-12/h4-8,13H,3H2,1-2H3.
What are the key properties of 2-ethoxy-N-methylquinolin-3-amine?
2-ethoxy-N-methylquinolin-3-amine has a molecular weight of 202.26 g/mol, XLogP of 2.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-methylquinolin-3-amine is sourced from PubChem (CID 174800672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).