N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide

C18H18N2O4 — CID 661771

IUPACN-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide
SMILESCOc1ccc2c(c1)c(=O)cc(C)n2CC(=O)NCc1ccco1
InChIInChI=1S/C18H18N2O4/c1-12-8-17(21)15-9-13(23-2)5-6-16(15)20(12)11-18(22)19-10-14-4-3-7-24-14/h3-9H,10-11H2,1-2H3,(H,19,22)
InChIKeyLVARLSGJUCKSLQ-UHFFFAOYSA-N
MW326.35 g/mol
LogP2.23
Rot. Bonds5

About N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide

N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide (PubChem CID 661771) has the molecular formula C18H18N2O4 and a molecular weight of 326.35 g/mol. Its IUPAC name is N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide
PubChem CID661771
Molecular FormulaC18H18N2O4
Molecular Weight326.35 g/mol
Exact Mass326.13
IUPAC NameN-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide
SMILESCOc1ccc2c(c1)c(=O)cc(C)n2CC(=O)NCc1ccco1
InChIInChI=1S/C18H18N2O4/c1-12-8-17(21)15-9-13(23-2)5-6-16(15)20(12)11-18(22)19-10-14-4-3-7-24-14/h3-9H,10-11H2,1-2H3,(H,19,22)
InChIKeyLVARLSGJUCKSLQ-UHFFFAOYSA-N
XLogP2.23
TPSA73.47 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.35
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide (CID 661771) is N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide is COc1ccc2c(c1)c(=O)cc(C)n2CC(=O)NCc1ccco1.
What is the InChIKey of N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide?
The InChIKey is LVARLSGJUCKSLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O4/c1-12-8-17(21)15-9-13(23-2)5-6-16(15)20(12)11-18(22)19-10-14-4-3-7-24-14/h3-9H,10-11H2,1-2H3,(H,19,22).
What are the key properties of N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide?
N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide has a molecular weight of 326.35 g/mol, XLogP of 2.23, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(furan-2-ylmethyl)-2-(6-methoxy-2-methyl-4-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 661771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).