N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine

C16H22N2O2 — CID 133445379

IUPACN-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine
SMILESCCOCCN(C)c1cc(C)nc2c(OC)cccc12
InChIInChI=1S/C16H22N2O2/c1-5-20-10-9-18(3)14-11-12(2)17-16-13(14)7-6-8-15(16)19-4/h6-8,11H,5,9-10H2,1-4H3
InChIKeyPWEJWNQTLOLMDV-UHFFFAOYSA-N
MW274.36 g/mol
LogP3.02
Rot. Bonds6

About N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine

N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine (PubChem CID 133445379) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine
PubChem CID133445379
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC NameN-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine
SMILESCCOCCN(C)c1cc(C)nc2c(OC)cccc12
InChIInChI=1S/C16H22N2O2/c1-5-20-10-9-18(3)14-11-12(2)17-16-13(14)7-6-8-15(16)19-4/h6-8,11H,5,9-10H2,1-4H3
InChIKeyPWEJWNQTLOLMDV-UHFFFAOYSA-N
XLogP3.02
TPSA34.59 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[(8-methoxy-2-methylquinolin-4-yl)-methylamino]propanoic acid
CID 122048748
1-(8-methoxy-2-methylquinolin-4-yl)-N-methylmethanamine
CID 82449649
4-[2-ethoxyethyl(methyl)amino]-2,6-dimethylpyridine-3-carboxylic acid
CID 81075122
N-[(8-methoxy-2-methylquinolin-4-yl)methyl]butan-2-amine
CID 82449656
N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
CID 798265
4-[3-(ethoxymethyl)pyrrolidin-1-yl]-8-methoxy-2-methylquinoline
CID 133368592
2-ethoxy-8-methoxy-4-methylquinoline
CID 70328444
4-(2-ethylimidazol-1-yl)-8-methoxy-2-methylquinoline
CID 110435976
3-N-(2-ethoxyethyl)-3-N,2-dimethylbenzene-1,3-diamine
CID 81059669
8-methoxy-N-(4-methoxy-2,2-dimethylbutyl)-2-methylquinolin-4-amine
CID 133459634
5-(chloromethyl)-N-(2-ethoxyethyl)-N,2-dimethylpyridin-4-amine
CID 81234440
4-(dimethylamino)-8-methoxyquinoline-2-carbonitrile
CID 82242563

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine?
The IUPAC name of N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine (CID 133445379) is N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine.
What is the SMILES notation for N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine?
The canonical SMILES for N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine is CCOCCN(C)c1cc(C)nc2c(OC)cccc12.
What is the InChIKey of N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine?
The InChIKey is PWEJWNQTLOLMDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-5-20-10-9-18(3)14-11-12(2)17-16-13(14)7-6-8-15(16)19-4/h6-8,11H,5,9-10H2,1-4H3.
What are the key properties of N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine?
N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine has a molecular weight of 274.36 g/mol, XLogP of 3.02, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-8-methoxy-N,2-dimethylquinolin-4-amine is sourced from PubChem (CID 133445379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).