6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one

C17H23N3O — CID 43737988

IUPAC6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one
SMILESCN1C2CCC1CC(Nc1ccc3c(c1)CCC(=O)N3)C2
InChIInChI=1S/C17H23N3O/c1-20-14-4-5-15(20)10-13(9-14)18-12-3-6-16-11(8-12)2-7-17(21)19-16/h3,6,8,13-15,18H,2,4-5,7,9-10H2,1H3,(H,19,21)
InChIKeyQFQVRSVYYOREKG-UHFFFAOYSA-N
MW285.39 g/mol
LogP2.61
Rot. Bonds2

About 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one

6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43737988) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one
PubChem CID43737988
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one
SMILESCN1C2CCC1CC(Nc1ccc3c(c1)CCC(=O)N3)C2
InChIInChI=1S/C17H23N3O/c1-20-14-4-5-15(20)10-13(9-14)18-12-3-6-16-11(8-12)2-7-17(21)19-16/h3,6,8,13-15,18H,2,4-5,7,9-10H2,1H3,(H,19,21)
InChIKeyQFQVRSVYYOREKG-UHFFFAOYSA-N
XLogP2.61
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one with MolForge

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Related Compounds

6-[(3-aminocyclobutyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 80560774
6-[(4,4-dimethylcycloheptyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 65083527
6-[(2,3-dimethylcyclohexyl)amino]-3,4-dihydro-1H-quinolin-2-one
CID 64760457
ethane;6-(methylamino)-3,4-dihydro-1H-quinolin-2-one
CID 142404052
6-(3-methylbutan-2-ylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737992
6-(cyclopropylmethylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43738023
7-[[(3S)-1-cyclopropyl-2-oxopyrrolidin-3-yl]amino]-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 99775329
6-chloro-5-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-1,3-dihydroindol-2-one
CID 43691755
N-methyl-4-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]benzenesulfonamide
CID 43742532
6-(3-methylbutylamino)-3,4-dihydro-1H-quinolin-2-one
CID 43737958
6-(cyclopentylmethylamino)-3,4-dihydro-1H-quinolin-2-one
CID 62071402
N-(3-bromo-4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 113451938

Frequently Asked Questions

What is the IUPAC name of 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one (CID 43737988) is 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one is CN1C2CCC1CC(Nc1ccc3c(c1)CCC(=O)N3)C2.
What is the InChIKey of 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is QFQVRSVYYOREKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-20-14-4-5-15(20)10-13(9-14)18-12-3-6-16-11(8-12)2-7-17(21)19-16/h3,6,8,13-15,18H,2,4-5,7,9-10H2,1H3,(H,19,21).
What are the key properties of 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one?
6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 285.39 g/mol, XLogP of 2.61, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43737988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).