N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide

C21H21N3O5 — CID 10386012

IUPACN-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc3c(c2)CCC2(C3)NC(=O)NC2=O)c1
InChIInChI=1S/C21H21N3O5/c1-28-16-8-14(9-17(10-16)29-2)18(25)22-15-4-3-13-11-21(6-5-12(13)7-15)19(26)23-20(27)24-21/h3-4,7-10H,5-6,11H2,1-2H3,(H,22,25)(H2,23,24,26,27)
InChIKeyCMMZNHRDESPSGZ-UHFFFAOYSA-N
MW395.42 g/mol
LogP2.02
Rot. Bonds4

About N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide

N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide (PubChem CID 10386012) has the molecular formula C21H21N3O5 and a molecular weight of 395.42 g/mol. Its IUPAC name is N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide.

Molecular Properties

Compound NameN-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide
PubChem CID10386012
Molecular FormulaC21H21N3O5
Molecular Weight395.42 g/mol
Exact Mass395.15
IUPAC NameN-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc3c(c2)CCC2(C3)NC(=O)NC2=O)c1
InChIInChI=1S/C21H21N3O5/c1-28-16-8-14(9-17(10-16)29-2)18(25)22-15-4-3-13-11-21(6-5-12(13)7-15)19(26)23-20(27)24-21/h3-4,7-10H,5-6,11H2,1-2H3,(H,22,25)(H2,23,24,26,27)
InChIKeyCMMZNHRDESPSGZ-UHFFFAOYSA-N
XLogP2.02
TPSA105.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.42
LogP ≤ 52.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2',5'-dioxospiro[1,3-dihydroindene-2,4'-imidazolidine]-5-yl)-3,5-dimethoxybenzamide
CID 10407462
5-[(3-methoxy-5-methylphenyl)methylamino]spiro[1,3-dihydroindene-2,5'-imidazolidine]-2',4'-dione
CID 142942914
N-[4-(4-fluoroanilino)phenyl]-3,5-dimethoxybenzamide
CID 112986846
3,5-dimethoxy-N-[4-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7686372
3,5-dimethoxy-N-(1-methyl-2-oxo-3H-indol-5-yl)benzamide
CID 16801840
4-[(3,5-dimethoxybenzoyl)amino]benzoate
CID 3699347
N-(1-acetyl-3,4-dihydro-2H-quinolin-6-yl)-3,5-dimethoxybenzamide
CID 7656241
N-(2',5'-dioxospiro[1,3-dihydroindene-2,4'-imidazolidine]-5-yl)-2-(octylamino)acetamide
CID 145475245
3,5-dimethoxy-N-[1-(3-methylbutyl)-2-oxo-3,4-dihydroquinolin-6-yl]benzamide
CID 16927187
N-[4-(4-acetylanilino)phenyl]-3,5-dimethoxybenzamide
CID 112988213
3,5-dimethoxy-N-[4-methoxy-3-(2-oxopyrrolidin-1-yl)phenyl]benzamide
CID 7687052
N-[4-(1-aminoethyl)phenyl]-3,5-dimethoxybenzamide
CID 43822825

Frequently Asked Questions

What is the IUPAC name of N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide?
The IUPAC name of N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide (CID 10386012) is N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide.
What is the SMILES notation for N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide?
The canonical SMILES for N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide is COc1cc(OC)cc(C(=O)Nc2ccc3c(c2)CCC2(C3)NC(=O)NC2=O)c1.
What is the InChIKey of N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide?
The InChIKey is CMMZNHRDESPSGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O5/c1-28-16-8-14(9-17(10-16)29-2)18(25)22-15-4-3-13-11-21(6-5-12(13)7-15)19(26)23-20(27)24-21/h3-4,7-10H,5-6,11H2,1-2H3,(H,22,25)(H2,23,24,26,27).
What are the key properties of N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide?
N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide has a molecular weight of 395.42 g/mol, XLogP of 2.02, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2',5'-dioxospiro[7,8-dihydro-5H-naphthalene-6,4'-imidazolidine]-2-yl)-3,5-dimethoxybenzamide is sourced from PubChem (CID 10386012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).