2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide

C14H18N2O2 — CID 46616352

IUPAC2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C14H18N2O2/c1-10(2)14(18)15-11-6-3-4-7-12(11)16-9-5-8-13(16)17/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,18)
InChIKeyZGWUJQYGJHCLLB-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.41
Rot. Bonds3

About 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide

2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide (PubChem CID 46616352) has the molecular formula C14H18N2O2 and a molecular weight of 246.31 g/mol. Its IUPAC name is 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
PubChem CID46616352
Molecular FormulaC14H18N2O2
Molecular Weight246.31 g/mol
Exact Mass246.14
IUPAC Name2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide
SMILESCC(C)C(=O)Nc1ccccc1N1CCCC1=O
InChIInChI=1S/C14H18N2O2/c1-10(2)14(18)15-11-6-3-4-7-12(11)16-9-5-8-13(16)17/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,18)
InChIKeyZGWUJQYGJHCLLB-UHFFFAOYSA-N
XLogP2.41
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The IUPAC name of 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide (CID 46616352) is 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide.
What is the SMILES notation for 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The canonical SMILES for 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide is CC(C)C(=O)Nc1ccccc1N1CCCC1=O.
What is the InChIKey of 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
The InChIKey is ZGWUJQYGJHCLLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O2/c1-10(2)14(18)15-11-6-3-4-7-12(11)16-9-5-8-13(16)17/h3-4,6-7,10H,5,8-9H2,1-2H3,(H,15,18).
What are the key properties of 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide?
2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide has a molecular weight of 246.31 g/mol, XLogP of 2.41, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-(2-oxopyrrolidin-1-yl)phenyl]propanamide is sourced from PubChem (CID 46616352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).