2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

C13H18N2O2 — CID 56922070

IUPAC2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCC(C)NC(=O)c1cc2c([nH]c1=O)CCCC2
InChIInChI=1S/C13H18N2O2/c1-8(2)14-12(16)10-7-9-5-3-4-6-11(9)15-13(10)17/h7-8H,3-6H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyHUXBKRVLKSDLSD-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.39
Rot. Bonds2

About 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide

2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (PubChem CID 56922070) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
PubChem CID56922070
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
SMILESCC(C)NC(=O)c1cc2c([nH]c1=O)CCCC2
InChIInChI=1S/C13H18N2O2/c1-8(2)14-12(16)10-7-9-5-3-4-6-11(9)15-13(10)17/h7-8H,3-6H2,1-2H3,(H,14,16)(H,15,17)
InChIKeyHUXBKRVLKSDLSD-UHFFFAOYSA-N
XLogP1.39
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The IUPAC name of 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide (CID 56922070) is 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
What is the SMILES notation for 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The canonical SMILES for 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is CC(C)NC(=O)c1cc2c([nH]c1=O)CCCC2.
What is the InChIKey of 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
The InChIKey is HUXBKRVLKSDLSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-8(2)14-12(16)10-7-9-5-3-4-6-11(9)15-13(10)17/h7-8H,3-6H2,1-2H3,(H,14,16)(H,15,17).
What are the key properties of 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide?
2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide has a molecular weight of 234.30 g/mol, XLogP of 1.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N-propan-2-yl-5,6,7,8-tetrahydro-1H-quinoline-3-carboxamide is sourced from PubChem (CID 56922070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).