N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide

C24H24N2O3 — CID 175641671

IUPACN,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide
SMILESCN(C)C(=O)COc1ccc2ccc(-c3ccc(C4CNC(=O)C4)cc3)cc2c1
InChIInChI=1S/C24H24N2O3/c1-26(2)24(28)15-29-22-10-9-17-7-8-19(11-20(17)12-22)16-3-5-18(6-4-16)21-13-23(27)25-14-21/h3-12,21H,13-15H2,1-2H3,(H,25,27)
InChIKeyYEUIPFKZUWDBMI-UHFFFAOYSA-N
MW388.47 g/mol
LogP3.58
Rot. Bonds5

About N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide

N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide (PubChem CID 175641671) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide
PubChem CID175641671
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC NameN,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide
SMILESCN(C)C(=O)COc1ccc2ccc(-c3ccc(C4CNC(=O)C4)cc3)cc2c1
InChIInChI=1S/C24H24N2O3/c1-26(2)24(28)15-29-22-10-9-17-7-8-19(11-20(17)12-22)16-3-5-18(6-4-16)21-13-23(27)25-14-21/h3-12,21H,13-15H2,1-2H3,(H,25,27)
InChIKeyYEUIPFKZUWDBMI-UHFFFAOYSA-N
XLogP3.58
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide?
The IUPAC name of N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide (CID 175641671) is N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide.
What is the SMILES notation for N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide?
The canonical SMILES for N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide is CN(C)C(=O)COc1ccc2ccc(-c3ccc(C4CNC(=O)C4)cc3)cc2c1.
What is the InChIKey of N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide?
The InChIKey is YEUIPFKZUWDBMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-26(2)24(28)15-29-22-10-9-17-7-8-19(11-20(17)12-22)16-3-5-18(6-4-16)21-13-23(27)25-14-21/h3-12,21H,13-15H2,1-2H3,(H,25,27).
What are the key properties of N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide?
N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide has a molecular weight of 388.47 g/mol, XLogP of 3.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-[7-[4-(5-oxopyrrolidin-3-yl)phenyl]naphthalen-2-yl]oxyacetamide is sourced from PubChem (CID 175641671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).