N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide

C16H20N4O4 — CID 56908804

IUPACN-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide
SMILESCN1CC(=O)N(c2cccc(NC(=O)CC3COCCN3)c2)C1=O
InChIInChI=1S/C16H20N4O4/c1-19-9-15(22)20(16(19)23)13-4-2-3-11(7-13)18-14(21)8-12-10-24-6-5-17-12/h2-4,7,12,17H,5-6,8-10H2,1H3,(H,18,21)
InChIKeyPCYPLNYODDDQMM-UHFFFAOYSA-N
MW332.36 g/mol
LogP0.40
Rot. Bonds4

About N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide

N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide (PubChem CID 56908804) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide.

Molecular Properties

Compound NameN-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide
PubChem CID56908804
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC NameN-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide
SMILESCN1CC(=O)N(c2cccc(NC(=O)CC3COCCN3)c2)C1=O
InChIInChI=1S/C16H20N4O4/c1-19-9-15(22)20(16(19)23)13-4-2-3-11(7-13)18-14(21)8-12-10-24-6-5-17-12/h2-4,7,12,17H,5-6,8-10H2,1H3,(H,18,21)
InChIKeyPCYPLNYODDDQMM-UHFFFAOYSA-N
XLogP0.40
TPSA90.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(2-methyl-1,3-thiazol-4-yl)phenyl]-2-[(3R)-morpholin-3-yl]acetamide
CID 95720015
N-[4-(1,3-dioxolan-2-yl)phenyl]-2-morpholin-3-ylacetamide
CID 106911781
N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-(2-oxoquinoxalin-1-yl)acetamide
CID 136577009
2-pyrrolidin-2-yl-N-(3-pyrrolidin-1-ylphenyl)acetamide
CID 61365428
2-[(3R)-morpholin-3-yl]-1-phenylethanone
CID 95396636
2-morpholin-3-yl-1-phenylethanone
CID 14753828
N-[4-(4-methyl-6-oxo-1H-pyrimidin-2-yl)phenyl]-2-morpholin-3-ylacetamide;hydrochloride
CID 137064245
2-[(3S)-morpholin-3-yl]-N-(8-oxo-5,6,7,9-tetrahydrocarbazol-2-yl)acetamide
CID 95719956
N-[3-(2-oxoimidazolidin-1-yl)phenyl]-2-pyrrolidin-2-ylacetamide;hydrochloride
CID 119727665
N-[3-(2-oxo-1,3-diazinan-1-yl)phenyl]-2-pyrrolidin-2-ylacetamide
CID 119809570
N-[3-(2-oxopyrrolidin-1-yl)phenyl]-2-thiomorpholin-3-ylacetamide
CID 119935630
N-[4-(furan-2-ylmethylsulfanyl)phenyl]-2-morpholin-3-ylacetamide
CID 56889679

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide?
The IUPAC name of N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide (CID 56908804) is N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide.
What is the SMILES notation for N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide?
The canonical SMILES for N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide is CN1CC(=O)N(c2cccc(NC(=O)CC3COCCN3)c2)C1=O.
What is the InChIKey of N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide?
The InChIKey is PCYPLNYODDDQMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-19-9-15(22)20(16(19)23)13-4-2-3-11(7-13)18-14(21)8-12-10-24-6-5-17-12/h2-4,7,12,17H,5-6,8-10H2,1H3,(H,18,21).
What are the key properties of N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide?
N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide has a molecular weight of 332.36 g/mol, XLogP of 0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-methyl-2,5-dioxoimidazolidin-1-yl)phenyl]-2-morpholin-3-ylacetamide is sourced from PubChem (CID 56908804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).