6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine

C14H16Br2N2O — CID 103416750

IUPAC6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine
SMILESCCc1c(C)nc2c(Br)cc(Br)c(OC)c2c1NC
InChIInChI=1S/C14H16Br2N2O/c1-5-8-7(2)18-13-9(15)6-10(16)14(19-4)11(13)12(8)17-3/h6H,5H2,1-4H3,(H,17,18)
InChIKeySTHAHBNZBDMASF-UHFFFAOYSA-N
MW388.10 g/mol
LogP4.68
Rot. Bonds3

About 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine

6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine (PubChem CID 103416750) has the molecular formula C14H16Br2N2O and a molecular weight of 388.10 g/mol. Its IUPAC name is 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine.

Molecular Properties

Compound Name6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine
PubChem CID103416750
Molecular FormulaC14H16Br2N2O
Molecular Weight388.10 g/mol
Exact Mass385.96
IUPAC Name6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine
SMILESCCc1c(C)nc2c(Br)cc(Br)c(OC)c2c1NC
InChIInChI=1S/C14H16Br2N2O/c1-5-8-7(2)18-13-9(15)6-10(16)14(19-4)11(13)12(8)17-3/h6H,5H2,1-4H3,(H,17,18)
InChIKeySTHAHBNZBDMASF-UHFFFAOYSA-N
XLogP4.68
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.10
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6,8-dibromo-3-ethyl-5-methoxy-2-methylquinolin-4-amine
CID 103416775
5-bromo-3-ethyl-8-methoxy-N,2-dimethylquinolin-4-amine
CID 63483485
6,8-dibromo-5-methoxy-N-methyl-2-propylquinolin-4-amine
CID 103416764
3-ethyl-N,2,5,8-tetramethylquinolin-4-amine
CID 62204126
5,8-dibromo-3-ethyl-2-methyl-N-propylquinolin-4-amine
CID 63482930
(5-bromo-3-ethyl-8-fluoro-2-methylquinolin-4-yl)hydrazine
CID 62250940
8-chloro-3-ethyl-5-fluoro-N,2-dimethylquinolin-4-amine
CID 107531258
ethyl 6,8-dibromo-4-hydrazinyl-5-methoxyquinoline-3-carboxylate
CID 103416812
5,8-dibromo-N,2,3-trimethylquinolin-4-amine
CID 63483840
8-bromo-4-chloro-3-ethyl-5-fluoro-2-methylquinoline
CID 107628279
6,8-dibromo-5-methoxy-2-(methoxymethyl)-N-propylquinolin-4-amine
CID 103416760
methyl 6,8-dibromo-4-ethoxy-5-methoxyquinoline-2-carboxylate
CID 103416918

Frequently Asked Questions

What is the IUPAC name of 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine?
The IUPAC name of 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine (CID 103416750) is 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine.
What is the SMILES notation for 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine?
The canonical SMILES for 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine is CCc1c(C)nc2c(Br)cc(Br)c(OC)c2c1NC.
What is the InChIKey of 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine?
The InChIKey is STHAHBNZBDMASF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16Br2N2O/c1-5-8-7(2)18-13-9(15)6-10(16)14(19-4)11(13)12(8)17-3/h6H,5H2,1-4H3,(H,17,18).
What are the key properties of 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine?
6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine has a molecular weight of 388.10 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dibromo-3-ethyl-5-methoxy-N,2-dimethylquinolin-4-amine is sourced from PubChem (CID 103416750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).