6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one

C14H20N2O — CID 43737992

IUPAC6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESCC(C)C(C)Nc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H20N2O/c1-9(2)10(3)15-12-5-6-13-11(8-12)4-7-14(17)16-13/h5-6,8-10,15H,4,7H2,1-3H3,(H,16,17)
InChIKeyNQSGSVWWAZIDHO-UHFFFAOYSA-N
MW232.33 g/mol
LogP3.03
Rot. Bonds3

About 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one

6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43737992) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
PubChem CID43737992
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
SMILESCC(C)C(C)Nc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H20N2O/c1-9(2)10(3)15-12-5-6-13-11(8-12)4-7-14(17)16-13/h5-6,8-10,15H,4,7H2,1-3H3,(H,16,17)
InChIKeyNQSGSVWWAZIDHO-UHFFFAOYSA-N
XLogP3.03
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

6-(1-methylsulfonylpropan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 64629940
6-[1-(4-hydroxyphenyl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 43737991
6-[1-(4-methyl-2-pyridinyl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 126801805
ethane;6-(methylamino)-3,4-dihydro-1H-quinolin-2-one
CID 142404052
6-(3-methylbutylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737958
2-bromo-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)propanamide
CID 107903528
6-[1-(5-ethylthiophen-2-yl)ethylamino]-3,4-dihydro-1H-quinolin-2-one
CID 61335706
6-[[4-(azepan-1-yl)-4-oxobutan-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 75472339
3-amino-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butanamide
CID 60837196
(2S)-2-amino-3,3-dimethyl-N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butanamide
CID 61154271
6-[[(2R)-1-oxo-1-(4-phenylpiperazin-1-yl)propan-2-yl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 34310061
6-[[(1S)-1-(3-tert-butyl-1,2,4-oxadiazol-5-yl)ethyl]amino]-3,4-dihydro-1H-quinolin-2-one
CID 34308913

Frequently Asked Questions

What is the IUPAC name of 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one (CID 43737992) is 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one is CC(C)C(C)Nc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is NQSGSVWWAZIDHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-9(2)10(3)15-12-5-6-13-11(8-12)4-7-14(17)16-13/h5-6,8-10,15H,4,7H2,1-3H3,(H,16,17).
What are the key properties of 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one?
6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 232.33 g/mol, XLogP of 3.03, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43737992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).