N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide

C14H18N2O4 — CID 47111322

IUPACN-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCCC2=O)c(OC)c1
InChIInChI=1S/C14H18N2O4/c1-19-10-5-6-11(12(8-10)20-2)15-13(17)9-16-7-3-4-14(16)18/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17)
InChIKeyIUMNHFGECMUYEY-UHFFFAOYSA-N
MW278.31 g/mol
LogP1.26
Rot. Bonds5

About N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide

N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide (PubChem CID 47111322) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
PubChem CID47111322
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC NameN-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2CCCC2=O)c(OC)c1
InChIInChI=1S/C14H18N2O4/c1-19-10-5-6-11(12(8-10)20-2)15-13(17)9-16-7-3-4-14(16)18/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17)
InChIKeyIUMNHFGECMUYEY-UHFFFAOYSA-N
XLogP1.26
TPSA67.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-fluoro-2-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 78864389
2-(6,8-difluoro-3,4-dihydro-2H-quinolin-1-yl)-N-(2,4-dimethoxyphenyl)acetamide
CID 43065879
N-[2,5-dimethoxy-4-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]phenyl]benzamide
CID 9374401
N-(2-butoxy-5-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 78864329
N-(4-bromophenyl)-4-[2-(2,4-dimethoxyanilino)-2-oxoethyl]-3-oxopiperazine-1-carboxamide
CID 50833014
N-(2,4-dimethoxyphenyl)-2-(2,3-dioxo-4-phenylpiperazin-1-yl)acetamide
CID 167997381
N-(2,4-dimethoxyphenyl)-2-[4-[2-oxo-2-(propan-2-ylamino)ethyl]-1,4-diazepan-1-yl]acetamide
CID 30721755
N-(2,4-dimethoxyphenyl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide
CID 18086226
N-(4-methoxy-3-methylphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 87032394
N-(2,4-dimethoxyphenyl)-2-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]acetamide
CID 9130137
methyl 2-[[2-(2-oxopyrrolidin-1-yl)acetyl]amino]benzoate
CID 43406096
N-(2,4-dimethoxyphenyl)-2-(1-methylpiperidin-4-yl)acetamide
CID 95969570

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide (CID 47111322) is N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide is COc1ccc(NC(=O)CN2CCCC2=O)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide?
The InChIKey is IUMNHFGECMUYEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c1-19-10-5-6-11(12(8-10)20-2)15-13(17)9-16-7-3-4-14(16)18/h5-6,8H,3-4,7,9H2,1-2H3,(H,15,17).
What are the key properties of N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide?
N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide has a molecular weight of 278.31 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-2-(2-oxopyrrolidin-1-yl)acetamide is sourced from PubChem (CID 47111322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).