2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide

C19H26N4O3 — CID 51177673

IUPAC2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2ccccc2N2CCCC2)C1=O
InChIInChI=1S/C19H26N4O3/c1-3-19(4-2)17(25)23(18(26)21-19)13-16(24)20-14-9-5-6-10-15(14)22-11-7-8-12-22/h5-6,9-10H,3-4,7-8,11-13H2,1-2H3,(H,20,24)(H,21,26)
InChIKeyNWPNPRJLLAKOEJ-UHFFFAOYSA-N
MW358.44 g/mol
LogP2.34
Rot. Bonds6

About 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide

2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 51177673) has the molecular formula C19H26N4O3 and a molecular weight of 358.44 g/mol. Its IUPAC name is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
PubChem CID51177673
Molecular FormulaC19H26N4O3
Molecular Weight358.44 g/mol
Exact Mass358.20
IUPAC Name2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESCCC1(CC)NC(=O)N(CC(=O)Nc2ccccc2N2CCCC2)C1=O
InChIInChI=1S/C19H26N4O3/c1-3-19(4-2)17(25)23(18(26)21-19)13-16(24)20-14-9-5-6-10-15(14)22-11-7-8-12-22/h5-6,9-10H,3-4,7-8,11-13H2,1-2H3,(H,20,24)(H,21,26)
InChIKeyNWPNPRJLLAKOEJ-UHFFFAOYSA-N
XLogP2.34
TPSA81.75 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.44
LogP ≤ 52.34
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

2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-piperidin-1-ylphenyl)acetamide
CID 26871371
2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 8009535
N-[2-(azepan-1-yl)phenyl]-2-[(5R,6R)-6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 30656543
N-(2-piperidin-1-ylphenyl)-2-[(5R,9R)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetamide
CID 25333245
N-(2-chloro-3-pyridinyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 7181002
N-(3-chloro-2-ethoxyphenyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 51124680
N-(2-piperidin-1-ylphenyl)propanamide
CID 960826
N-(5-chloro-2-piperidin-1-ylphenyl)-2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 26292277
N-[2-(azepan-1-yl)phenyl]-2-(1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl)acetamide
CID 128925593
2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(2-pyrrolidin-1-ylphenyl)acetamide
CID 98347786
N-(4-acetamidophenyl)-2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 7181137
2-(3-oxo-1,4-benzothiazin-4-yl)-N-(2-piperidin-1-ylphenyl)acetamide
CID 51195953

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide (CID 51177673) is 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide is CCC1(CC)NC(=O)N(CC(=O)Nc2ccccc2N2CCCC2)C1=O.
What is the InChIKey of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is NWPNPRJLLAKOEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O3/c1-3-19(4-2)17(25)23(18(26)21-19)13-16(24)20-14-9-5-6-10-15(14)22-11-7-8-12-22/h5-6,9-10H,3-4,7-8,11-13H2,1-2H3,(H,20,24)(H,21,26).
What are the key properties of 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 358.44 g/mol, XLogP of 2.34, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-diethyl-2,5-dioxoimidazolidin-1-yl)-N-(2-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 51177673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).