1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine

C15H25N3 — CID 60971754

IUPAC1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine
SMILESCCN(CC)CCN1CCCc2c(N)cccc21
InChIInChI=1S/C15H25N3/c1-3-17(4-2)11-12-18-10-6-7-13-14(16)8-5-9-15(13)18/h5,8-9H,3-4,6-7,10-12,16H2,1-2H3
InChIKeyOOJBWHLUESVMRS-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.36
Rot. Bonds5

About 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine

1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine (PubChem CID 60971754) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine.

Molecular Properties

Compound Name1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine
PubChem CID60971754
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine
SMILESCCN(CC)CCN1CCCc2c(N)cccc21
InChIInChI=1S/C15H25N3/c1-3-17(4-2)11-12-18-10-6-7-13-14(16)8-5-9-15(13)18/h5,8-9H,3-4,6-7,10-12,16H2,1-2H3
InChIKeyOOJBWHLUESVMRS-UHFFFAOYSA-N
XLogP2.36
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-butyl-3,4-dihydro-2H-quinolin-5-amine
CID 60972612
1-(2-methylsulfonylethyl)-3,4-dihydro-2H-quinolin-5-amine
CID 54881503
1-(3-methylsulfanylpropyl)-3,4-dihydro-2H-quinolin-5-amine
CID 115777493
3-(5-amino-3,4-dihydro-2H-quinolin-1-yl)-N,N-dimethylpropanamide
CID 60972396
1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-1-benzazepin-5-one
CID 114336724
2-[2-(5-amino-3,4-dihydro-2H-quinolin-1-yl)ethoxy]propanenitrile
CID 114266629
1-(pyrimidin-2-ylmethyl)-3,4-dihydro-2H-quinolin-5-amine
CID 55108301
1-(2-propylsulfonylethyl)-2,3-dihydroindol-4-amine
CID 106725995
1-[3-(2,2,2-trifluoroethoxy)propyl]-3,4-dihydro-2H-quinolin-5-amine
CID 61491630
1-[(5-amino-3,4-dihydro-2H-quinolin-1-yl)methyl]cyclopentan-1-ol
CID 65212762
2-(5-amino-3,4-dihydro-2H-quinolin-1-yl)-N-cyclopropyl-N-methylacetamide
CID 61489284
1-methyl-2,3,4,5-tetrahydro-1-benzazepin-6-amine
CID 83852967

Frequently Asked Questions

What is the IUPAC name of 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine?
The IUPAC name of 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine (CID 60971754) is 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine.
What is the SMILES notation for 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine?
The canonical SMILES for 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine is CCN(CC)CCN1CCCc2c(N)cccc21.
What is the InChIKey of 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine?
The InChIKey is OOJBWHLUESVMRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-3-17(4-2)11-12-18-10-6-7-13-14(16)8-5-9-15(13)18/h5,8-9H,3-4,6-7,10-12,16H2,1-2H3.
What are the key properties of 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine?
1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine has a molecular weight of 247.39 g/mol, XLogP of 2.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(diethylamino)ethyl]-3,4-dihydro-2H-quinolin-5-amine is sourced from PubChem (CID 60971754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).