1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one

C16H22N2O — CID 63915018

IUPAC1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one
SMILESCCNC(CN1C(=O)CCc2ccccc21)C1CC1
InChIInChI=1S/C16H22N2O/c1-2-17-14(12-7-8-12)11-18-15-6-4-3-5-13(15)9-10-16(18)19/h3-6,12,14,17H,2,7-11H2,1H3
InChIKeyABCIVJNYSLEXIG-UHFFFAOYSA-N
MW258.36 g/mol
LogP2.35
Rot. Bonds5

About 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one

1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one (PubChem CID 63915018) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one
PubChem CID63915018
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one
SMILESCCNC(CN1C(=O)CCc2ccccc21)C1CC1
InChIInChI=1S/C16H22N2O/c1-2-17-14(12-7-8-12)11-18-15-6-4-3-5-13(15)9-10-16(18)19/h3-6,12,14,17H,2,7-11H2,1H3
InChIKeyABCIVJNYSLEXIG-UHFFFAOYSA-N
XLogP2.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-(ethylamino)-2-(oxolan-3-yl)ethyl]-3,4-dihydroquinolin-2-one
CID 104747148
1-[2-cyclohexyl-2-(methylamino)ethyl]-3,4-dihydroquinolin-2-one
CID 104747147
1-ethyl-3,4-dihydroquinolin-2-one
CID 14580225
1-[(2S)-2-hydroxypropyl]-3,4-dihydroquinolin-2-one
CID 103935304
N-(2-amino-1-cyclopropylethyl)-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanamide;hydrochloride
CID 119613182
1-(2-amino-3,3-dimethylbutyl)-3,4-dihydroquinolin-2-one
CID 16792075
2-acetamido-3-(2-oxo-3,4-dihydroquinolin-1-yl)propanoic acid
CID 64583291
1-[2-hydroxy-3-(2-methylpropylamino)propyl]-3,4-dihydroquinolin-2-one
CID 115475527
1-[2-(methylamino)butyl]-4,5-dihydro-3H-1-benzazepin-2-one
CID 62041220
1-[3-(ethylamino)-2-hydroxypropyl]-4,5-dihydro-3H-1-benzazepin-2-one
CID 43343208
ethyl 3-hydroxy-4-(2-oxo-3,4-dihydroquinolin-1-yl)butanoate
CID 82778791
1-hexyl-3,4-dihydroquinolin-2-one
CID 91805726

Frequently Asked Questions

What is the IUPAC name of 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one?
The IUPAC name of 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one (CID 63915018) is 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one?
The canonical SMILES for 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one is CCNC(CN1C(=O)CCc2ccccc21)C1CC1.
What is the InChIKey of 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one?
The InChIKey is ABCIVJNYSLEXIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-2-17-14(12-7-8-12)11-18-15-6-4-3-5-13(15)9-10-16(18)19/h3-6,12,14,17H,2,7-11H2,1H3.
What are the key properties of 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one?
1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one has a molecular weight of 258.36 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-cyclopropyl-2-(ethylamino)ethyl]-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 63915018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).