N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide

C18H24N2O4 — CID 3745707

IUPACN-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide
SMILESCCCCCCC(=O)N(O)C1CC(=O)N(c2ccc(C)cc2)C1=O
InChIInChI=1S/C18H24N2O4/c1-3-4-5-6-7-16(21)20(24)15-12-17(22)19(18(15)23)14-10-8-13(2)9-11-14/h8-11,15,24H,3-7,12H2,1-2H3
InChIKeyYGYWXJBHSBZDDQ-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.82
Rot. Bonds7

About N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide

N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide (PubChem CID 3745707) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide.

Molecular Properties

Compound NameN-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide
PubChem CID3745707
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC NameN-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide
SMILESCCCCCCC(=O)N(O)C1CC(=O)N(c2ccc(C)cc2)C1=O
InChIInChI=1S/C18H24N2O4/c1-3-4-5-6-7-16(21)20(24)15-12-17(22)19(18(15)23)14-10-8-13(2)9-11-14/h8-11,15,24H,3-7,12H2,1-2H3
InChIKeyYGYWXJBHSBZDDQ-UHFFFAOYSA-N
XLogP2.82
TPSA77.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.40
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-oxo-2-(2,2,4-trimethyl-1(2H)-quinolinyl)ethyl]-2,5-pyrrolidinedione
CID 713603
N-[1-(4-fluorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-hydroxyheptanamide
CID 3719436
1-Benzyl-3-(hydroxyanilino)-2,5-pyrrolidinedione
CID 2837843
(1S,2S)-1-(dimethylcarbamoyl)-1-(4-acetamidophenyl)-3-[(3S)-3-fluoropyrrolidin-1-yl]-3-oxopropan-2-aminium
CID 23647704
(1S,2S)-1-(dimethylcarbamoyl)-3-[(3S)-3-fluoropyrrolidin-1-yl]-1-[4-(N-methylacetamido)phenyl]-3-oxopropan-2-aminium
CID 23647708
1-(4-Methylphenyl)-3-[(4-methylphenyl)amino]-2,5-pyrrolidinedione
CID 2927700
N-[1-(4-chlorophenyl)-2,5-dioxopyrrolidin-3-yl]-N-hydroxyheptanamide
CID 3711227
3,3'-(Hydroxyazanediyl)bis(1-(p-tolyl)pyrrolidine-2,5-dione)
CID 662190
N-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-N-hydroxyhexanamide
CID 664797
3-(4-Benzylpiperazin-1-yl)-1-phenylpyrrolidine-2,5-dione
CID 2833553
1-(4-Methylphenyl)-3-(phenylamino)pyrrolidine-2,5-dione
CID 2855947
3-(4-Methylpiperazin-1-yl)-1-(4-(2-oxopyrrolidin-1-yl)benzyl)pyrrolidine-2,5-dione
CID 3811187

Frequently Asked Questions

What is the IUPAC name of N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide?
The IUPAC name of N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide (CID 3745707) is N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide.
What is the SMILES notation for N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide?
The canonical SMILES for N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide is CCCCCCC(=O)N(O)C1CC(=O)N(c2ccc(C)cc2)C1=O.
What is the InChIKey of N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide?
The InChIKey is YGYWXJBHSBZDDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-3-4-5-6-7-16(21)20(24)15-12-17(22)19(18(15)23)14-10-8-13(2)9-11-14/h8-11,15,24H,3-7,12H2,1-2H3.
What are the key properties of N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide?
N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide has a molecular weight of 332.40 g/mol, XLogP of 2.82, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-hydroxy-N-[1-(4-methylphenyl)-2,5-dioxopyrrolidin-3-yl]heptanamide is sourced from PubChem (CID 3745707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).