6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one

C11H15N3O — CID 43455516

IUPAC6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESCCNc1cc2c(cc1N)CCC(=O)N2
InChIInChI=1S/C11H15N3O/c1-2-13-10-6-9-7(5-8(10)12)3-4-11(15)14-9/h5-6,13H,2-4,12H2,1H3,(H,14,15)
InChIKeyBPGQIBOAJOVMCP-UHFFFAOYSA-N
MW205.26 g/mol
LogP1.59
Rot. Bonds2

About 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one

6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43455516) has the molecular formula C11H15N3O and a molecular weight of 205.26 g/mol. Its IUPAC name is 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one
PubChem CID43455516
Molecular FormulaC11H15N3O
Molecular Weight205.26 g/mol
Exact Mass205.12
IUPAC Name6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESCCNc1cc2c(cc1N)CCC(=O)N2
InChIInChI=1S/C11H15N3O/c1-2-13-10-6-9-7(5-8(10)12)3-4-11(15)14-9/h5-6,13H,2-4,12H2,1H3,(H,14,15)
InChIKeyBPGQIBOAJOVMCP-UHFFFAOYSA-N
XLogP1.59
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 51.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

6-amino-7-(2-methylpropylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43455514
6-amino-7-[(3-methyl-2-propan-2-ylbutyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 102903606
2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)amino]-N-methylacetamide
CID 43383610
6-amino-7-(butan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43455512
6-amino-7-[3-(dimethylamino)propylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43455538
N-[2-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)amino]ethyl]methanesulfonamide
CID 43545918
6-amino-7-[(4-hydroxy-2,2-dimethylbutyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 106140613
6-amino-7-[(1-hydroxy-2-methylbutan-2-yl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 64551358
6-amino-7-[(2-methyl-3-methylsulfanylpropyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 63982484
6-amino-7-[(3-methylcyclopentyl)methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 107411249
N-[3-[(6-amino-2-oxo-3,4-dihydro-1H-quinolin-7-yl)amino]propyl]methanesulfonamide
CID 106333687
6-amino-7-(1-hydroxypropan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43498917

Frequently Asked Questions

What is the IUPAC name of 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one (CID 43455516) is 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one is CCNc1cc2c(cc1N)CCC(=O)N2.
What is the InChIKey of 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is BPGQIBOAJOVMCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O/c1-2-13-10-6-9-7(5-8(10)12)3-4-11(15)14-9/h5-6,13H,2-4,12H2,1H3,(H,14,15).
What are the key properties of 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one?
6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 205.26 g/mol, XLogP of 1.59, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-7-(ethylamino)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43455516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).