N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide

C13H16N2O2 — CID 57177979

IUPACN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide
SMILESCC(=O)Nc1cccc2c1NC(=O)CC2(C)C
InChIInChI=1S/C13H16N2O2/c1-8(16)14-10-6-4-5-9-12(10)15-11(17)7-13(9,2)3/h4-6H,7H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyLNPVMALNZVVCAR-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.26
Rot. Bonds1

About N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide

N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide (PubChem CID 57177979) has the molecular formula C13H16N2O2 and a molecular weight of 232.28 g/mol. Its IUPAC name is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide.

Molecular Properties

Compound NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide
PubChem CID57177979
Molecular FormulaC13H16N2O2
Molecular Weight232.28 g/mol
Exact Mass232.12
IUPAC NameN-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide
SMILESCC(=O)Nc1cccc2c1NC(=O)CC2(C)C
InChIInChI=1S/C13H16N2O2/c1-8(16)14-10-6-4-5-9-12(10)15-11(17)7-13(9,2)3/h4-6H,7H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyLNPVMALNZVVCAR-UHFFFAOYSA-N
XLogP2.26
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide?
The IUPAC name of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide (CID 57177979) is N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide.
What is the SMILES notation for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide?
The canonical SMILES for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide is CC(=O)Nc1cccc2c1NC(=O)CC2(C)C.
What is the InChIKey of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide?
The InChIKey is LNPVMALNZVVCAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2O2/c1-8(16)14-10-6-4-5-9-12(10)15-11(17)7-13(9,2)3/h4-6H,7H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide?
N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide has a molecular weight of 232.28 g/mol, XLogP of 2.26, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4,4-dimethyl-2-oxo-1,3-dihydroquinolin-8-yl)acetamide is sourced from PubChem (CID 57177979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).