ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide

C12H16N2O2 — CID 91307130

IUPACethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide
SMILESCC.NC(=O)c1cccc2c1NCCC2=O
InChIInChI=1S/C10H10N2O2.C2H6/c11-10(14)7-3-1-2-6-8(13)4-5-12-9(6)7;1-2/h1-3,12H,4-5H2,(H2,11,14);1-2H3
InChIKeyZNJAGANHYKWIRZ-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.81
Rot. Bonds1

About ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide

ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide (PubChem CID 91307130) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide.

Molecular Properties

Compound Nameethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide
PubChem CID91307130
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Nameethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide
SMILESCC.NC(=O)c1cccc2c1NCCC2=O
InChIInChI=1S/C10H10N2O2.C2H6/c11-10(14)7-3-1-2-6-8(13)4-5-12-9(6)7;1-2/h1-3,12H,4-5H2,(H2,11,14);1-2H3
InChIKeyZNJAGANHYKWIRZ-UHFFFAOYSA-N
XLogP1.81
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide?
The IUPAC name of ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide (CID 91307130) is ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide.
What is the SMILES notation for ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide?
The canonical SMILES for ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide is CC.NC(=O)c1cccc2c1NCCC2=O.
What is the InChIKey of ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide?
The InChIKey is ZNJAGANHYKWIRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O2.C2H6/c11-10(14)7-3-1-2-6-8(13)4-5-12-9(6)7;1-2/h1-3,12H,4-5H2,(H2,11,14);1-2H3.
What are the key properties of ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide?
ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide has a molecular weight of 220.27 g/mol, XLogP of 1.81, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-oxo-2,3-dihydro-1H-quinoline-8-carboxamide is sourced from PubChem (CID 91307130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).