N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide

C15H19N3O7S — CID 59957311

IUPACN-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide
SMILESCOc1ccc(S(=O)(=O)CC(CN2C(=O)CN(C)C2=O)C(=O)NO)cc1
InChIInChI=1S/C15H19N3O7S/c1-17-8-13(19)18(15(17)21)7-10(14(20)16-22)9-26(23,24)12-5-3-11(25-2)4-6-12/h3-6,10,22H,7-9H2,1-2H3,(H,16,20)
InChIKeyMAMRODGQCKBZPM-UHFFFAOYSA-N
MW385.40 g/mol
LogP-0.52
Rot. Bonds7

About N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide

N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide (PubChem CID 59957311) has the molecular formula C15H19N3O7S and a molecular weight of 385.40 g/mol. Its IUPAC name is N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide.

Molecular Properties

Compound NameN-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide
PubChem CID59957311
Molecular FormulaC15H19N3O7S
Molecular Weight385.40 g/mol
Exact Mass385.09
IUPAC NameN-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide
SMILESCOc1ccc(S(=O)(=O)CC(CN2C(=O)CN(C)C2=O)C(=O)NO)cc1
InChIInChI=1S/C15H19N3O7S/c1-17-8-13(19)18(15(17)21)7-10(14(20)16-22)9-26(23,24)12-5-3-11(25-2)4-6-12/h3-6,10,22H,7-9H2,1-2H3,(H,16,20)
InChIKeyMAMRODGQCKBZPM-UHFFFAOYSA-N
XLogP-0.52
TPSA133.32 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.40
LogP ≤ 5-0.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-[(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)methyl]-N-hydroxy-3-(4-methoxyphenyl)sulfonylpropanamide
CID 59957308
2-[(3-butyl-2,5-dioxoimidazolidin-1-yl)methyl]-3-[4-(4-chlorophenyl)phenyl]sulfonyl-N-hydroxypropanamide
CID 23505558
2-[(3-butyl-2,4-dioxoimidazolidin-1-yl)methyl]-3-[4-(4-chlorophenyl)phenyl]sulfonyl-N-hydroxypropanamide
CID 23505545
2-(4-methoxyphenyl)-2-[[2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetyl]amino]-N-[4-(trimethyl-λ4-sulfanyl)phenyl]acetamide
CID 129055039
2-[(4-butoxyphenyl)sulfonylmethyl]-N,2-dihydroxy-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide
CID 18459333
N-(4-methoxyphenyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 8777093
(2R,4S)-N-hydroxy-1-(4-methoxyphenyl)sulfonyl-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)pyrrolidine-2-carboxamide
CID 10549612
(2R)-3-(4-methoxyphenyl)sulfonyl-2-methylpropanoic acid
CID 28753247
[1-(4-bromophenyl)-2-(4-methoxyphenyl)sulfonylethyl] (2,5-dioxopyrrolidin-1-yl) carbonate
CID 58481897
[(2S)-1-(4-methoxyphenyl)-1-oxopropan-2-yl] 4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanoate
CID 9061811
2-[(2-anilinoacetyl)amino]-N-hydroxy-3-(4-methoxyphenyl)sulfonylpropanamide
CID 18368954
N'-[2-(4-methoxyphenyl)acetyl]-5-(3-methyl-2,5-dioxoimidazolidin-1-yl)pentanehydrazide
CID 166452026

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide?
The IUPAC name of N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide (CID 59957311) is N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide.
What is the SMILES notation for N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide?
The canonical SMILES for N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide is COc1ccc(S(=O)(=O)CC(CN2C(=O)CN(C)C2=O)C(=O)NO)cc1.
What is the InChIKey of N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide?
The InChIKey is MAMRODGQCKBZPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O7S/c1-17-8-13(19)18(15(17)21)7-10(14(20)16-22)9-26(23,24)12-5-3-11(25-2)4-6-12/h3-6,10,22H,7-9H2,1-2H3,(H,16,20).
What are the key properties of N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide?
N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide has a molecular weight of 385.40 g/mol, XLogP of -0.52, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-2-[(4-methoxyphenyl)sulfonylmethyl]-3-(3-methyl-2,5-dioxoimidazolidin-1-yl)propanamide is sourced from PubChem (CID 59957311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).