N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide

C19H18N2O4 — CID 51129571

IUPACN-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide
SMILESO=C1CC(N(C(=O)COc2ccc3ccccc3c2)C2CC2)C(=O)N1
InChIInChI=1S/C19H18N2O4/c22-17-10-16(19(24)20-17)21(14-6-7-14)18(23)11-25-15-8-5-12-3-1-2-4-13(12)9-15/h1-5,8-9,14,16H,6-7,10-11H2,(H,20,22,24)
InChIKeyTWDNMZGDNLWULI-UHFFFAOYSA-N
MW338.36 g/mol
LogP1.62
Rot. Bonds5

About N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide

N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide (PubChem CID 51129571) has the molecular formula C19H18N2O4 and a molecular weight of 338.36 g/mol. Its IUPAC name is N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide
PubChem CID51129571
Molecular FormulaC19H18N2O4
Molecular Weight338.36 g/mol
Exact Mass338.13
IUPAC NameN-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide
SMILESO=C1CC(N(C(=O)COc2ccc3ccccc3c2)C2CC2)C(=O)N1
InChIInChI=1S/C19H18N2O4/c22-17-10-16(19(24)20-17)21(14-6-7-14)18(23)11-25-15-8-5-12-3-1-2-4-13(12)9-15/h1-5,8-9,14,16H,6-7,10-11H2,(H,20,22,24)
InChIKeyTWDNMZGDNLWULI-UHFFFAOYSA-N
XLogP1.62
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.36
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide?
The IUPAC name of N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide (CID 51129571) is N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide.
What is the SMILES notation for N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide?
The canonical SMILES for N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide is O=C1CC(N(C(=O)COc2ccc3ccccc3c2)C2CC2)C(=O)N1.
What is the InChIKey of N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide?
The InChIKey is TWDNMZGDNLWULI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O4/c22-17-10-16(19(24)20-17)21(14-6-7-14)18(23)11-25-15-8-5-12-3-1-2-4-13(12)9-15/h1-5,8-9,14,16H,6-7,10-11H2,(H,20,22,24).
What are the key properties of N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide?
N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide has a molecular weight of 338.36 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2,5-dioxopyrrolidin-3-yl)-2-naphthalen-2-yloxyacetamide is sourced from PubChem (CID 51129571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).