2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide

C21H24ClN3O2 — CID 15990372

IUPAC2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C2=O)cc1
InChIInChI=1S/C21H24ClN3O2/c1-16-2-4-17(5-3-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-6-8-19(22)9-7-18/h2-9H,10-15H2,1H3,(H,23,26)
InChIKeyGSNFOQMHHLVEIQ-UHFFFAOYSA-N
MW385.90 g/mol
LogP3.24
Rot. Bonds7

About 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide

2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide (PubChem CID 15990372) has the molecular formula C21H24ClN3O2 and a molecular weight of 385.90 g/mol. Its IUPAC name is 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
PubChem CID15990372
Molecular FormulaC21H24ClN3O2
Molecular Weight385.90 g/mol
Exact Mass385.16
IUPAC Name2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide
SMILESCc1ccc(CCNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C2=O)cc1
InChIInChI=1S/C21H24ClN3O2/c1-16-2-4-17(5-3-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-6-8-19(22)9-7-18/h2-9H,10-15H2,1H3,(H,23,26)
InChIKeyGSNFOQMHHLVEIQ-UHFFFAOYSA-N
XLogP3.24
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.90
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Ambenonium
CID 2131
2-Imidazolidinone, 1-((4-chlorophenyl)methyl)-
CID 5076481
N-[(4-chlorophenyl)methyl]-2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)acetamide
CID 2083685
N-[(4-chlorophenyl)methyl]-2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)acetamide
CID 2102967
N-[(4-chlorophenyl)methyl]-2-(8-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetamide
CID 2412458
2-(4-benzylpiperazin-1-yl)-N-[(4-chlorophenyl)methyl]acetamide
CID 2441640
3-((4-Chlorophenyl)methyl)-2-thioxo-4-imidazolidinone
CID 2726678
N-benzyl-2-[(4-chlorophenyl)methyl-methylamino]acetamide
CID 4879874
2-[(3-chlorophenyl)methyl-methylamino]-N-(1-phenylethyl)acetamide
CID 4881897
2-[3-(4-chlorobenzyl)-2-oxoimidazolidin-1-yl]-N-(3-isopropoxypropyl)acetamide
CID 20851422
(4S)-N-[(2,4-dichlorophenyl)methyl]-3-methyl-2-oxoimidazolidine-4-carboxamide
CID 50898450
1-benzyl-3-[(2R)-1-[4-(4-chlorophenyl)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]urea
CID 57889141

Frequently Asked Questions

What is the IUPAC name of 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The IUPAC name of 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide (CID 15990372) is 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide.
What is the SMILES notation for 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The canonical SMILES for 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide is Cc1ccc(CCNC(=O)CN2CCN(Cc3ccc(Cl)cc3)C2=O)cc1.
What is the InChIKey of 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
The InChIKey is GSNFOQMHHLVEIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24ClN3O2/c1-16-2-4-17(5-3-16)10-11-23-20(26)15-25-13-12-24(21(25)27)14-18-6-8-19(22)9-7-18/h2-9H,10-15H2,1H3,(H,23,26).
What are the key properties of 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide?
2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide has a molecular weight of 385.90 g/mol, XLogP of 3.24, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-[(4-chlorophenyl)methyl]-2-oxoimidazolidin-1-yl]-N-[2-(4-methylphenyl)ethyl]acetamide is sourced from PubChem (CID 15990372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).