N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide

C19H18N2O3 — CID 110680381

IUPACN-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2c(=O)c(C)cc3ccccc32)c1
InChIInChI=1S/C19H18N2O3/c1-13-10-14-6-3-4-9-17(14)21(19(13)23)12-18(22)20-15-7-5-8-16(11-15)24-2/h3-11H,12H2,1-2H3,(H,20,22)
InChIKeyQWQLBEHYHHSOLR-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.96
Rot. Bonds4

About N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide

N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide (PubChem CID 110680381) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
PubChem CID110680381
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC NameN-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide
SMILESCOc1cccc(NC(=O)Cn2c(=O)c(C)cc3ccccc32)c1
InChIInChI=1S/C19H18N2O3/c1-13-10-14-6-3-4-9-17(14)21(19(13)23)12-18(22)20-15-7-5-8-16(11-15)24-2/h3-11H,12H2,1-2H3,(H,20,22)
InChIKeyQWQLBEHYHHSOLR-UHFFFAOYSA-N
XLogP2.96
TPSA60.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide (CID 110680381) is N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide is COc1cccc(NC(=O)Cn2c(=O)c(C)cc3ccccc32)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide?
The InChIKey is QWQLBEHYHHSOLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-13-10-14-6-3-4-9-17(14)21(19(13)23)12-18(22)20-15-7-5-8-16(11-15)24-2/h3-11H,12H2,1-2H3,(H,20,22).
What are the key properties of N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide?
N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide has a molecular weight of 322.36 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(3-methyl-2-oxoquinolin-1-yl)acetamide is sourced from PubChem (CID 110680381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).