2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide

C15H18N2O2 — CID 100741082

IUPAC2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)NC(C)C
InChIInChI=1S/C15H18N2O2/c1-10(2)16-15(19)9-17-7-6-14(18)12-8-11(3)4-5-13(12)17/h4-8,10H,9H2,1-3H3,(H,16,19)
InChIKeyKWEGBLVHGVAFML-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.83
Rot. Bonds3

About 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide

2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide (PubChem CID 100741082) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
PubChem CID100741082
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide
SMILESCc1ccc2c(c1)c(=O)ccn2CC(=O)NC(C)C
InChIInChI=1S/C15H18N2O2/c1-10(2)16-15(19)9-17-7-6-14(18)12-8-11(3)4-5-13(12)17/h4-8,10H,9H2,1-3H3,(H,16,19)
InChIKeyKWEGBLVHGVAFML-UHFFFAOYSA-N
XLogP1.83
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide?
The IUPAC name of 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide (CID 100741082) is 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide is Cc1ccc2c(c1)c(=O)ccn2CC(=O)NC(C)C.
What is the InChIKey of 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide?
The InChIKey is KWEGBLVHGVAFML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-10(2)16-15(19)9-17-7-6-14(18)12-8-11(3)4-5-13(12)17/h4-8,10H,9H2,1-3H3,(H,16,19).
What are the key properties of 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide?
2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide has a molecular weight of 258.32 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-4-oxoquinolin-1-yl)-N-propan-2-ylacetamide is sourced from PubChem (CID 100741082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).