2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide

C19H19N3O4 — CID 4881210

IUPAC2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(CN1C(=O)NC2(CCCc3ccccc32)C1=O)NCc1ccco1
InChIInChI=1S/C19H19N3O4/c23-16(20-11-14-7-4-10-26-14)12-22-17(24)19(21-18(22)25)9-3-6-13-5-1-2-8-15(13)19/h1-2,4-5,7-8,10H,3,6,9,11-12H2,(H,20,23)(H,21,25)
InChIKeyGJNGQGMVWQZXHJ-UHFFFAOYSA-N
MW353.38 g/mol
LogP1.68
Rot. Bonds4

About 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide

2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide (PubChem CID 4881210) has the molecular formula C19H19N3O4 and a molecular weight of 353.38 g/mol. Its IUPAC name is 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide
PubChem CID4881210
Molecular FormulaC19H19N3O4
Molecular Weight353.38 g/mol
Exact Mass353.14
IUPAC Name2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide
SMILESO=C(CN1C(=O)NC2(CCCc3ccccc32)C1=O)NCc1ccco1
InChIInChI=1S/C19H19N3O4/c23-16(20-11-14-7-4-10-26-14)12-22-17(24)19(21-18(22)25)9-3-6-13-5-1-2-8-15(13)19/h1-2,4-5,7-8,10H,3,6,9,11-12H2,(H,20,23)(H,21,25)
InChIKeyGJNGQGMVWQZXHJ-UHFFFAOYSA-N
XLogP1.68
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.38
LogP ≤ 51.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide?
The IUPAC name of 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide (CID 4881210) is 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide is O=C(CN1C(=O)NC2(CCCc3ccccc32)C1=O)NCc1ccco1.
What is the InChIKey of 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide?
The InChIKey is GJNGQGMVWQZXHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O4/c23-16(20-11-14-7-4-10-26-14)12-22-17(24)19(21-18(22)25)9-3-6-13-5-1-2-8-15(13)19/h1-2,4-5,7-8,10H,3,6,9,11-12H2,(H,20,23)(H,21,25).
What are the key properties of 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide?
2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide has a molecular weight of 353.38 g/mol, XLogP of 1.68, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2',5'-dioxospiro[2,3-dihydro-1H-naphthalene-4,4'-imidazolidine]-1'-yl)-N-(furan-2-ylmethyl)acetamide is sourced from PubChem (CID 4881210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).