6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one

C14H20N2O3 — CID 103486501

IUPAC6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one
SMILESCCOCC(C)Oc1cc2c(cc1N)CCC(=O)N2
InChIInChI=1S/C14H20N2O3/c1-3-18-8-9(2)19-13-7-12-10(6-11(13)15)4-5-14(17)16-12/h6-7,9H,3-5,8,15H2,1-2H3,(H,16,17)
InChIKeyYWGPRTONGOTVHS-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.96
Rot. Bonds5

About 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one

6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 103486501) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one
PubChem CID103486501
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one
SMILESCCOCC(C)Oc1cc2c(cc1N)CCC(=O)N2
InChIInChI=1S/C14H20N2O3/c1-3-18-8-9(2)19-13-7-12-10(6-11(13)15)4-5-14(17)16-12/h6-7,9H,3-5,8,15H2,1-2H3,(H,16,17)
InChIKeyYWGPRTONGOTVHS-UHFFFAOYSA-N
XLogP1.96
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

7-amino-6-(4-methylpentan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one
CID 43449981
7-amino-6-(2-ethoxyethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 43382899
6-amino-7-heptoxy-3,4-dihydro-1H-quinolin-2-one
CID 43455700
6-amino-7-trimethylsilyloxy-3,4-dihydro-1H-quinolin-2-one
CID 167723388
7-amino-8-methoxy-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 71755958
6-amino-7-[3-(2-methoxyethoxy)propoxy]-3,4-dihydro-1H-quinolin-2-one
CID 103401017
6-amino-7-(butan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43455512
6-amino-7-(4-methylphenoxy)-3,4-dihydro-1H-quinolin-2-one
CID 43455675
5-amino-6-(2-methylpropoxy)-1,3-dihydroindol-2-one
CID 43451909
6-amino-7-(2-cyclopropylethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 106199650
6-bromo-7-ethoxy-3,4-dihydro-1H-quinolin-2-one
CID 66560026
6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43455516

Frequently Asked Questions

What is the IUPAC name of 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one (CID 103486501) is 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one is CCOCC(C)Oc1cc2c(cc1N)CCC(=O)N2.
What is the InChIKey of 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is YWGPRTONGOTVHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-3-18-8-9(2)19-13-7-12-10(6-11(13)15)4-5-14(17)16-12/h6-7,9H,3-5,8,15H2,1-2H3,(H,16,17).
What are the key properties of 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one?
6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 264.32 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-7-(1-ethoxypropan-2-yloxy)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 103486501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).