2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide

C19H20N4O5 — CID 24981567

IUPAC2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide
SMILESCc1ccc(C2(C)NC(=O)N(CC(=O)NNC(=O)c3ccoc3C)C2=O)cc1
InChIInChI=1S/C19H20N4O5/c1-11-4-6-13(7-5-11)19(3)17(26)23(18(27)20-19)10-15(24)21-22-16(25)14-8-9-28-12(14)2/h4-9H,10H2,1-3H3,(H,20,27)(H,21,24)(H,22,25)
InChIKeyTUYGXMKAQSHRBA-UHFFFAOYSA-N
MW384.39 g/mol
LogP1.12
Rot. Bonds4

About 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide

2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide (PubChem CID 24981567) has the molecular formula C19H20N4O5 and a molecular weight of 384.39 g/mol. Its IUPAC name is 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide.

Molecular Properties

Compound Name2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide
PubChem CID24981567
Molecular FormulaC19H20N4O5
Molecular Weight384.39 g/mol
Exact Mass384.14
IUPAC Name2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide
SMILESCc1ccc(C2(C)NC(=O)N(CC(=O)NNC(=O)c3ccoc3C)C2=O)cc1
InChIInChI=1S/C19H20N4O5/c1-11-4-6-13(7-5-11)19(3)17(26)23(18(27)20-19)10-15(24)21-22-16(25)14-8-9-28-12(14)2/h4-9H,10H2,1-3H3,(H,20,27)(H,21,24)(H,22,25)
InChIKeyTUYGXMKAQSHRBA-UHFFFAOYSA-N
XLogP1.12
TPSA120.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.39
LogP ≤ 51.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-methyl-N'-[2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]furan-3-carbohydrazide
CID 24981566
2-fluoro-N'-[2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]benzohydrazide
CID 25162375
N'-[2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]benzohydrazide
CID 26865674
2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
CID 42964323
N-(4-fluorophenyl)-2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2581954
2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-[(2S)-pentan-2-yl]acetamide
CID 2581518
2-[(4R)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-pentylacetamide
CID 40748614
(2R)-2-[[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]propanoic acid
CID 119370203
N-cyclopentyl-2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2582043
N-[2-(methylamino)propyl]-2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 120831423
N-(3,5-dichlorophenyl)-2-[(4R)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7178689
2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-(propylcarbamoyl)acetamide
CID 2581674

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide?
The IUPAC name of 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide (CID 24981567) is 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide.
What is the SMILES notation for 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide?
The canonical SMILES for 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide is Cc1ccc(C2(C)NC(=O)N(CC(=O)NNC(=O)c3ccoc3C)C2=O)cc1.
What is the InChIKey of 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide?
The InChIKey is TUYGXMKAQSHRBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O5/c1-11-4-6-13(7-5-11)19(3)17(26)23(18(27)20-19)10-15(24)21-22-16(25)14-8-9-28-12(14)2/h4-9H,10H2,1-3H3,(H,20,27)(H,21,24)(H,22,25).
What are the key properties of 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide?
2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide has a molecular weight of 384.39 g/mol, XLogP of 1.12, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N'-[2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]furan-3-carbohydrazide is sourced from PubChem (CID 24981567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).