2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide

C19H18ClN3O4 — CID 47054953

IUPAC2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide
SMILESO=C(COCc1ccccc1Cl)Nc1cccc(CN2C(=O)CNC2=O)c1
InChIInChI=1S/C19H18ClN3O4/c20-16-7-2-1-5-14(16)11-27-12-17(24)22-15-6-3-4-13(8-15)10-23-18(25)9-21-19(23)26/h1-8H,9-12H2,(H,21,26)(H,22,24)
InChIKeyIQJNUMGCYZPOTF-UHFFFAOYSA-N
MW387.82 g/mol
LogP2.55
Rot. Bonds7

About 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide

2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide (PubChem CID 47054953) has the molecular formula C19H18ClN3O4 and a molecular weight of 387.82 g/mol. Its IUPAC name is 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide.

Molecular Properties

Compound Name2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide
PubChem CID47054953
Molecular FormulaC19H18ClN3O4
Molecular Weight387.82 g/mol
Exact Mass387.10
IUPAC Name2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide
SMILESO=C(COCc1ccccc1Cl)Nc1cccc(CN2C(=O)CNC2=O)c1
InChIInChI=1S/C19H18ClN3O4/c20-16-7-2-1-5-14(16)11-27-12-17(24)22-15-6-3-4-13(8-15)10-23-18(25)9-21-19(23)26/h1-8H,9-12H2,(H,21,26)(H,22,24)
InChIKeyIQJNUMGCYZPOTF-UHFFFAOYSA-N
XLogP2.55
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.82
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]-2-(2-ethylphenoxy)acetamide
CID 55617362
2-(2,6-dimethylphenoxy)-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide
CID 55617163
N-[3-(carbamoylamino)phenyl]-2-[(2-chlorophenyl)methoxy]acetamide
CID 51086475
2-[(4-chlorophenyl)methylsulfanyl]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide
CID 55617218
[2-(3-methoxyanilino)-2-oxoethyl] 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate
CID 33067811
2-amino-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]propanamide
CID 119288680
3-(5-chlorothiophen-2-yl)-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]propanamide
CID 47054951
4-bromo-2-chloro-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]benzamide
CID 60509721
N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]-3-(4-propan-2-ylphenyl)propanamide
CID 55853093
[2-(2-benzylanilino)-2-oxoethyl] 3-[(2,5-dioxoimidazolidin-1-yl)methyl]benzoate
CID 33068963
1-[(2-chlorophenyl)methyl]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]-3-methylthieno[3,2-d]pyrazole-5-carboxamide
CID 47026683
3,3-dicyclopropyl-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]prop-2-enamide
CID 71889492

Frequently Asked Questions

What is the IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide?
The IUPAC name of 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide (CID 47054953) is 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide.
What is the SMILES notation for 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide?
The canonical SMILES for 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide is O=C(COCc1ccccc1Cl)Nc1cccc(CN2C(=O)CNC2=O)c1.
What is the InChIKey of 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide?
The InChIKey is IQJNUMGCYZPOTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O4/c20-16-7-2-1-5-14(16)11-27-12-17(24)22-15-6-3-4-13(8-15)10-23-18(25)9-21-19(23)26/h1-8H,9-12H2,(H,21,26)(H,22,24).
What are the key properties of 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide?
2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide has a molecular weight of 387.82 g/mol, XLogP of 2.55, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-chlorophenyl)methoxy]-N-[3-[(2,5-dioxoimidazolidin-1-yl)methyl]phenyl]acetamide is sourced from PubChem (CID 47054953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).