4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one

C12H16N2O3 — CID 84628304

IUPAC4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one
SMILESCOc1cc(OC)c2c(c1)C(N)CC(=O)N2C
InChIInChI=1S/C12H16N2O3/c1-14-11(15)6-9(13)8-4-7(16-2)5-10(17-3)12(8)14/h4-5,9H,6,13H2,1-3H3
InChIKeyKRYZCTGMAMIGIQ-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.07
Rot. Bonds2

About 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one

4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 84628304) has the molecular formula C12H16N2O3 and a molecular weight of 236.27 g/mol. Its IUPAC name is 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID84628304
Molecular FormulaC12H16N2O3
Molecular Weight236.27 g/mol
Exact Mass236.12
IUPAC Name4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one
SMILESCOc1cc(OC)c2c(c1)C(N)CC(=O)N2C
InChIInChI=1S/C12H16N2O3/c1-14-11(15)6-9(13)8-4-7(16-2)5-10(17-3)12(8)14/h4-5,9H,6,13H2,1-3H3
InChIKeyKRYZCTGMAMIGIQ-UHFFFAOYSA-N
XLogP1.07
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(2-aminoethyl)-6-methoxy-1,8-dimethyl-3,4-dihydroquinolin-2-one
CID 84633155
4,6-dimethoxy-2,3-dihydro-1H-inden-1-amine
CID 61382953
1-methyl-4-(2,4,6-trimethoxyphenyl)pyrrolidin-2-one
CID 154196757
3-amino-1-(2,5-dimethoxyphenyl)pyrrolidine-2,5-dione
CID 82159648
3-(3,5-dimethoxyphenyl)-1-methylpyrrolidine-2,5-dione
CID 3050266
5,7-dimethoxy-1-methyl-2,3-dihydroindole-2-carboxylic acid
CID 83870301
3-amino-5,7-dimethoxy-2,3-dihydro-1H-indene-1-carboxylic acid
CID 82159256
4-(aminomethyl)-6,8-dimethoxy-3,4-dihydro-2H-isoquinolin-1-one
CID 82129525
(1R)-6,8-dimethoxy-1,2-dimethyl-1,4-dihydroisoquinolin-3-one
CID 102347263
3-amino-1-(2,4-dimethoxyphenyl)piperidine-2,6-dione
CID 82160067
methyl (2S,3R)-1-methyl-5-oxo-3-(2,4,6-trimethoxyphenyl)pyrrolidine-2-carboxylate
CID 67165242
[5-(3,5-dimethoxy-2-methylphenyl)-1-methylpyrrolidin-3-yl]methanamine
CID 117415847

Frequently Asked Questions

What is the IUPAC name of 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one (CID 84628304) is 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one is COc1cc(OC)c2c(c1)C(N)CC(=O)N2C.
What is the InChIKey of 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is KRYZCTGMAMIGIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O3/c1-14-11(15)6-9(13)8-4-7(16-2)5-10(17-3)12(8)14/h4-5,9H,6,13H2,1-3H3.
What are the key properties of 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one?
4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 236.27 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6,8-dimethoxy-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 84628304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).