6-amino-1-ethyl-3,4-dihydroquinolin-2-one

C11H14N2O — CID 43446541

IUPAC6-amino-1-ethyl-3,4-dihydroquinolin-2-one
SMILESCCN1C(=O)CCc2cc(N)ccc21
InChIInChI=1S/C11H14N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h4-5,7H,2-3,6,12H2,1H3
InChIKeyJJLRYSSROUZRMM-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.57
Rot. Bonds1

About 6-amino-1-ethyl-3,4-dihydroquinolin-2-one

6-amino-1-ethyl-3,4-dihydroquinolin-2-one (PubChem CID 43446541) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 6-amino-1-ethyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-amino-1-ethyl-3,4-dihydroquinolin-2-one
PubChem CID43446541
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name6-amino-1-ethyl-3,4-dihydroquinolin-2-one
SMILESCCN1C(=O)CCc2cc(N)ccc21
InChIInChI=1S/C11H14N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h4-5,7H,2-3,6,12H2,1H3
InChIKeyJJLRYSSROUZRMM-UHFFFAOYSA-N
XLogP1.57
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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-amino-1-ethyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-amino-1-ethyl-3,4-dihydroquinolin-2-one (CID 43446541) is 6-amino-1-ethyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-amino-1-ethyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-amino-1-ethyl-3,4-dihydroquinolin-2-one is CCN1C(=O)CCc2cc(N)ccc21.
What is the InChIKey of 6-amino-1-ethyl-3,4-dihydroquinolin-2-one?
The InChIKey is JJLRYSSROUZRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h4-5,7H,2-3,6,12H2,1H3.
What are the key properties of 6-amino-1-ethyl-3,4-dihydroquinolin-2-one?
6-amino-1-ethyl-3,4-dihydroquinolin-2-one has a molecular weight of 190.25 g/mol, XLogP of 1.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-ethyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 43446541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).