6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one

C15H19N3O2 — CID 91942406

IUPAC6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC(=NN1CCOCC1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H19N3O2/c1-11(17-18-6-8-20-9-7-18)12-2-4-14-13(10-12)3-5-15(19)16-14/h2,4,10H,3,5-9H2,1H3,(H,16,19)
InChIKeyFRBHXFPWHBSCDW-UHFFFAOYSA-N
MW273.34 g/mol
LogP1.63
Rot. Bonds2

About 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one

6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 91942406) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID91942406
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC(=NN1CCOCC1)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H19N3O2/c1-11(17-18-6-8-20-9-7-18)12-2-4-14-13(10-12)3-5-15(19)16-14/h2,4,10H,3,5-9H2,1H3,(H,16,19)
InChIKeyFRBHXFPWHBSCDW-UHFFFAOYSA-N
XLogP1.63
TPSA53.93 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yl)-N-morpholin-4-ylethanimine
CID 71943522
(2-morpholin-4-yl-2-oxoethyl) 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 18101051
(2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-morpholin-4-ylbenzoate
CID 95047735
(3S)-4-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)morpholine-3-carboxylic acid
CID 125133531
N-[4-[(2-morpholin-4-ylacetyl)amino]phenyl]-2-oxo-3,4-dihydro-1H-quinoline-6-carboxamide
CID 30780885
6-[3-(hydroxymethyl)morpholine-4-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 102712814
methyl 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 9451992
3-(2-oxo-3,4-dihydro-1H-quinoline-6-carbonyl)oxetane-3-carbonitrile
CID 116922262
(2-oxo-3,4-dihydro-1H-quinolin-6-yl) 4-morpholin-4-ylsulfonylbenzoate
CID 18266738
6-(3,5-dimethylpiperidine-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 86911989
6-[3-(1-methylpyrrol-2-yl)morpholine-4-carbonyl]-3,4-dihydro-1H-quinolin-2-one
CID 86794079
6-(pyrrole-1-carbonyl)-3,4-dihydro-1H-quinolin-2-one
CID 70502328

Frequently Asked Questions

What is the IUPAC name of 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one (CID 91942406) is 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one is CC(=NN1CCOCC1)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is FRBHXFPWHBSCDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-11(17-18-6-8-20-9-7-18)12-2-4-14-13(10-12)3-5-15(19)16-14/h2,4,10H,3,5-9H2,1H3,(H,16,19).
What are the key properties of 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one?
6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 273.34 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(C-methyl-N-morpholin-4-ylcarbonimidoyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 91942406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).