N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide

C20H19ClN2O3 — CID 1364939

IUPACN-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide
SMILESCC(=O)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C20H19ClN2O3/c1-14(24)22(11-10-15-6-3-2-4-7-15)18-13-19(25)23(20(18)26)17-9-5-8-16(21)12-17/h2-9,12,18H,10-11,13H2,1H3/t18-/m1/s1
InChIKeyLXTYRGGUXKAVII-GOSISDBHSA-N
MW370.84 g/mol
LogP3.06
Rot. Bonds5

About N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide

N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide (PubChem CID 1364939) has the molecular formula C20H19ClN2O3 and a molecular weight of 370.84 g/mol. Its IUPAC name is N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound NameN-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide
PubChem CID1364939
Molecular FormulaC20H19ClN2O3
Molecular Weight370.84 g/mol
Exact Mass370.11
IUPAC NameN-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide
SMILESCC(=O)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O
InChIInChI=1S/C20H19ClN2O3/c1-14(24)22(11-10-15-6-3-2-4-7-15)18-13-19(25)23(20(18)26)17-9-5-8-16(21)12-17/h2-9,12,18H,10-11,13H2,1H3/t18-/m1/s1
InChIKeyLXTYRGGUXKAVII-GOSISDBHSA-N
XLogP3.06
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.84
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-N-(2-phenylethyl)acetamide
CID 3109144
N-[2-(3-chlorophenyl)ethyl]-N-[2,5-dioxo-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]acetamide
CID 23802024
N-[2,5-dioxo-1-(4-propan-2-ylphenyl)pyrrolidin-3-yl]-N-(2-phenylethyl)acetamide
CID 23915042
N-[2-(3-chlorophenyl)ethyl]-N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)butanamide
CID 23998873
N-benzyl-N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)acetamide
CID 3710802
N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)propanamide
CID 3121026
N-[(3R)-1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-[2-(4-methoxyphenyl)ethyl]acetamide
CID 1042410
2-(4-chlorophenyl)-N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide
CID 23998801
N-[2-(3-chlorophenyl)ethyl]-2-methyl-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]benzamide
CID 23803579
N-[2-(3-chlorophenyl)ethyl]-N-[1-(4-methoxyphenyl)-2,5-dioxopyrrolidin-3-yl]-2-phenylacetamide
CID 23998853
N-(1-adamantylmethyl)-N-[(3S)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]acetamide
CID 7288980
4-[[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-(2-phenylethyl)amino]-4-oxobut-2-enoic acid
CID 3109141

Frequently Asked Questions

What is the IUPAC name of N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide?
The IUPAC name of N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide (CID 1364939) is N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide.
What is the SMILES notation for N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide?
The canonical SMILES for N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide is CC(=O)N(CCc1ccccc1)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O.
What is the InChIKey of N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide?
The InChIKey is LXTYRGGUXKAVII-GOSISDBHSA-N. The full InChI is InChI=1S/C20H19ClN2O3/c1-14(24)22(11-10-15-6-3-2-4-7-15)18-13-19(25)23(20(18)26)17-9-5-8-16(21)12-17/h2-9,12,18H,10-11,13H2,1H3/t18-/m1/s1.
What are the key properties of N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide?
N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide has a molecular weight of 370.84 g/mol, XLogP of 3.06, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3R)-1-(3-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 1364939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).