6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one

C11H16N2O — CID 84618285

IUPAC6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one
SMILESCCn1c2c(ccc1=O)CC(N)CC2
InChIInChI=1S/C11H16N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h3,6,9H,2,4-5,7,12H2,1H3
InChIKeyFAFLLIORHPFYFQ-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.68
Rot. Bonds1

About 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one

6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one (PubChem CID 84618285) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one.

Molecular Properties

Compound Name6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one
PubChem CID84618285
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one
SMILESCCn1c2c(ccc1=O)CC(N)CC2
InChIInChI=1S/C11H16N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h3,6,9H,2,4-5,7,12H2,1H3
InChIKeyFAFLLIORHPFYFQ-UHFFFAOYSA-N
XLogP0.68
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one?
The IUPAC name of 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one (CID 84618285) is 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one.
What is the SMILES notation for 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one?
The canonical SMILES for 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one is CCn1c2c(ccc1=O)CC(N)CC2.
What is the InChIKey of 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one?
The InChIKey is FAFLLIORHPFYFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-13-10-5-4-9(12)7-8(10)3-6-11(13)14/h3,6,9H,2,4-5,7,12H2,1H3.
What are the key properties of 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one?
6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one has a molecular weight of 192.26 g/mol, XLogP of 0.68, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-1-ethyl-5,6,7,8-tetrahydroquinolin-2-one is sourced from PubChem (CID 84618285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).