6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine

C15H22N4O — CID 62844494

IUPAC6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine
SMILESCOCCN(C)CCNc1ccc2ncccc2c1N
InChIInChI=1S/C15H22N4O/c1-19(10-11-20-2)9-8-18-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,18H,8-11,16H2,1-2H3
InChIKeyUHAHZKJUMDOKHX-UHFFFAOYSA-N
MW274.37 g/mol
LogP1.81
Rot. Bonds7

About 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine

6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine (PubChem CID 62844494) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine.

Molecular Properties

Compound Name6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine
PubChem CID62844494
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine
SMILESCOCCN(C)CCNc1ccc2ncccc2c1N
InChIInChI=1S/C15H22N4O/c1-19(10-11-20-2)9-8-18-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,18H,8-11,16H2,1-2H3
InChIKeyUHAHZKJUMDOKHX-UHFFFAOYSA-N
XLogP1.81
TPSA63.41 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-N-(3,3-dimethylbutyl)quinoline-5,6-diamine
CID 89050951
6-N-ethylquinoline-5,6-diamine
CID 43809532
2-[2-[(5-aminoquinolin-6-yl)amino]ethoxy]ethanol
CID 62499591
2-[(5-aminoquinolin-6-yl)amino]ethyl carbamate
CID 83202979
3-chloro-1-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzene-1,2-diamine
CID 104834477
4-[(5-aminoquinolin-6-yl)amino]butan-1-ol
CID 106840255
6-N-prop-2-enylquinoline-5,6-diamine
CID 62500024
6-[(5-aminoquinolin-6-yl)amino]hexan-1-ol
CID 107844066
2-amino-3-[2-[2-methoxyethyl(methyl)amino]ethylamino]benzenesulfonamide
CID 115992668
6-N-[(3-methyl-2-pyridinyl)methyl]quinoline-5,6-diamine
CID 63305883
6-N-(2-cyclohexylethyl)quinoline-5,6-diamine
CID 60919863
4-bromo-2-N-[2-[2-methoxyethyl(methyl)amino]ethyl]benzene-1,2-diamine
CID 65342624

Frequently Asked Questions

What is the IUPAC name of 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine?
The IUPAC name of 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine (CID 62844494) is 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine.
What is the SMILES notation for 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine?
The canonical SMILES for 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine is COCCN(C)CCNc1ccc2ncccc2c1N.
What is the InChIKey of 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine?
The InChIKey is UHAHZKJUMDOKHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-19(10-11-20-2)9-8-18-14-6-5-13-12(15(14)16)4-3-7-17-13/h3-7,18H,8-11,16H2,1-2H3.
What are the key properties of 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine?
6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine has a molecular weight of 274.37 g/mol, XLogP of 1.81, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-[2-[2-methoxyethyl(methyl)amino]ethyl]quinoline-5,6-diamine is sourced from PubChem (CID 62844494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).