6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one

C17H20N2OS — CID 61335706

IUPAC6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1ccc(C(C)Nc2ccc3c(c2)CCC(=O)N3)s1
InChIInChI=1S/C17H20N2OS/c1-3-14-6-8-16(21-14)11(2)18-13-5-7-15-12(10-13)4-9-17(20)19-15/h5-8,10-11,18H,3-4,9H2,1-2H3,(H,19,20)
InChIKeyGZSTWPLHZBCLFA-UHFFFAOYSA-N
MW300.43 g/mol
LogP4.37
Rot. Bonds4

About 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one

6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 61335706) has the molecular formula C17H20N2OS and a molecular weight of 300.43 g/mol. Its IUPAC name is 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
PubChem CID61335706
Molecular FormulaC17H20N2OS
Molecular Weight300.43 g/mol
Exact Mass300.13
IUPAC Name6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
SMILESCCc1ccc(C(C)Nc2ccc3c(c2)CCC(=O)N3)s1
InChIInChI=1S/C17H20N2OS/c1-3-14-6-8-16(21-14)11(2)18-13-5-7-15-12(10-13)4-9-17(20)19-15/h5-8,10-11,18H,3-4,9H2,1-2H3,(H,19,20)
InChIKeyGZSTWPLHZBCLFA-UHFFFAOYSA-N
XLogP4.37
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 54.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737992
6-[1-(4-hydroxyphenyl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43737991
6-(1-methylsulfonylpropan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 64629940
6-[1-(4-methyl-2-pyridinyl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 126801805
6-[[(1S)-1-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 34308649
6-[[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 34308913
6-(3-methylbutylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737958
ethane;6-(methylamino)-3,4-dihydro-1H-quinolin-2-one
CID 142404052
6-[(5-bromothiophen-2-yl)methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43737971
6-[[(1R)-1-(5-phenyl-1,3-oxazol-2-yl)ethyl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 97021644
4-[1-(5-ethylthiophen-2-yl)ethylamino]benzoic acid
CID 61333563
6-[1-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 71942292

Frequently Asked Questions

What is the IUPAC name of 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one (CID 61335706) is 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one is CCc1ccc(C(C)Nc2ccc3c(c2)CCC(=O)N3)s1.
What is the InChIKey of 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is GZSTWPLHZBCLFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2OS/c1-3-14-6-8-16(21-14)11(2)18-13-5-7-15-12(10-13)4-9-17(20)19-15/h5-8,10-11,18H,3-4,9H2,1-2H3,(H,19,20).
What are the key properties of 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one?
6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 300.43 g/mol, XLogP of 4.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 61335706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).