3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one

C12H16N2O — CID 14627274

IUPAC3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCCNC1Cc2cccc(C)c2NC1=O
InChIInChI=1S/C12H16N2O/c1-3-13-10-7-9-6-4-5-8(2)11(9)14-12(10)15/h4-6,10,13H,3,7H2,1-2H3,(H,14,15)
InChIKeyWMUQFODVWVWPEZ-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.47
Rot. Bonds2

About 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one

3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 14627274) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one
PubChem CID14627274
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCCNC1Cc2cccc(C)c2NC1=O
InChIInChI=1S/C12H16N2O/c1-3-13-10-7-9-6-4-5-8(2)11(9)14-12(10)15/h4-6,10,13H,3,7H2,1-2H3,(H,14,15)
InChIKeyWMUQFODVWVWPEZ-UHFFFAOYSA-N
XLogP1.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one (CID 14627274) is 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one is CCNC1Cc2cccc(C)c2NC1=O.
What is the InChIKey of 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is WMUQFODVWVWPEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-3-13-10-7-9-6-4-5-8(2)11(9)14-12(10)15/h4-6,10,13H,3,7H2,1-2H3,(H,14,15).
What are the key properties of 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one?
3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 204.27 g/mol, XLogP of 1.47, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-8-methyl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 14627274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).