N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide

C19H18ClN3O4 — CID 5135167

IUPACN-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2C(=O)NC(C)(c3ccccc3)C2=O)cc1Cl
InChIInChI=1S/C19H18ClN3O4/c1-19(12-6-4-3-5-7-12)17(25)23(18(26)22-19)11-16(24)21-13-8-9-15(27-2)14(20)10-13/h3-10H,11H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyRBMTWAIWVHSQPS-UHFFFAOYSA-N
MW387.82 g/mol
LogP2.75
Rot. Bonds5

About N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide

N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide (PubChem CID 5135167) has the molecular formula C19H18ClN3O4 and a molecular weight of 387.82 g/mol. Its IUPAC name is N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
PubChem CID5135167
Molecular FormulaC19H18ClN3O4
Molecular Weight387.82 g/mol
Exact Mass387.10
IUPAC NameN-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
SMILESCOc1ccc(NC(=O)CN2C(=O)NC(C)(c3ccccc3)C2=O)cc1Cl
InChIInChI=1S/C19H18ClN3O4/c1-19(12-6-4-3-5-7-12)17(25)23(18(26)22-19)11-16(24)21-13-8-9-15(27-2)14(20)10-13/h3-10H,11H2,1-2H3,(H,21,24)(H,22,26)
InChIKeyRBMTWAIWVHSQPS-UHFFFAOYSA-N
XLogP2.75
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.82
LogP ≤ 52.75
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-chloro-4-methoxyphenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)acetamide
CID 2340853
N-(3-chloro-4-methoxyphenyl)-4-(2-oxopyrrolidin-1-yl)benzamide
CID 2540178
N-(3-Chloro-4-methoxyphenyl)-2-{8-methyl-2-oxo-3-phenyl-1,4-diazaspiro[4.5]dec-3-EN-1-YL}acetamide
CID 16012437
2-(3-chloro-N-(2-chloroacetyl)-4-methoxyanilino)-2-methyl-N-(2-phenylethyl)propanamide
CID 49766515
US10717708, Example 176
CID 129226959
N-(3-chloro-4-methoxyphenyl)-2-(2,4-dioxo-1,3-diazaspiro[4.4]nonan-3-yl)acetamide
CID 2366523
N-(3-chloro-4-methoxyphenyl)-2-phenylbutanamide
CID 2922609
Pyrrolidine-1,2-dicarboxylic acid 2-(2-chloro-benzylamide) 1-[(4-methoxy-phenyl)-amide]
CID 3219662
2-(3-chloro-4-methoxyphenyl)-3-(3-methylphenyl)hexahydro-1H-pyrrolo[1,2-c]imidazol-1-one
CID 3241338
N-(3-chloro-4-methoxyphenyl)-2-(3-ethoxypropylamino)-2-phenylacetamide
CID 3545299
N-(4-chloro-2-fluorophenyl)-2-[4-[4-(difluoromethoxy)phenyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 3934765
2-[4-(2-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[2-(difluoromethoxy)phenyl]acetamide
CID 4037266

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The IUPAC name of N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide (CID 5135167) is N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide is COc1ccc(NC(=O)CN2C(=O)NC(C)(c3ccccc3)C2=O)cc1Cl.
What is the InChIKey of N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The InChIKey is RBMTWAIWVHSQPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18ClN3O4/c1-19(12-6-4-3-5-7-12)17(25)23(18(26)22-19)11-16(24)21-13-8-9-15(27-2)14(20)10-13/h3-10H,11H2,1-2H3,(H,21,24)(H,22,26).
What are the key properties of N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide has a molecular weight of 387.82 g/mol, XLogP of 2.75, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-methoxyphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide is sourced from PubChem (CID 5135167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).