4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide

C18H24N2O4 — CID 167745572

IUPAC4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
SMILESCc1cc(NC(=O)CCCN2C(=O)CCC2=O)ccc1OC(C)C
InChIInChI=1S/C18H24N2O4/c1-12(2)24-15-7-6-14(11-13(15)3)19-16(21)5-4-10-20-17(22)8-9-18(20)23/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,19,21)
InChIKeyLTLMVXZNKGCQMH-UHFFFAOYSA-N
MW332.40 g/mol
LogP2.65
Rot. Bonds7

About 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide

4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide (PubChem CID 167745572) has the molecular formula C18H24N2O4 and a molecular weight of 332.40 g/mol. Its IUPAC name is 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide.

Molecular Properties

Compound Name4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
PubChem CID167745572
Molecular FormulaC18H24N2O4
Molecular Weight332.40 g/mol
Exact Mass332.17
IUPAC Name4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
SMILESCc1cc(NC(=O)CCCN2C(=O)CCC2=O)ccc1OC(C)C
InChIInChI=1S/C18H24N2O4/c1-12(2)24-15-7-6-14(11-13(15)3)19-16(21)5-4-10-20-17(22)8-9-18(20)23/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,19,21)
InChIKeyLTLMVXZNKGCQMH-UHFFFAOYSA-N
XLogP2.65
TPSA75.71 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 ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide 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

4-(methylamino)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide
CID 119802582
2-amino-N-(3-methyl-4-propan-2-yloxyphenyl)acetamide
CID 82494452
2-(cyclopropylmethylamino)-N-(3-methyl-4-propan-2-yloxyphenyl)acetamide
CID 119802601
6-(2,5-dioxopyrrolidin-1-yl)-N-(4-methylphenyl)hexanamide
CID 17035026
N-(3,4-dimethylphenyl)-4-(3-methyl-2,5-dioxoimidazolidin-1-yl)butanamide
CID 18160401
1-[2-(2,5-dioxoimidazolidin-1-yl)ethyl]-3-(3-methyl-4-propan-2-yloxyphenyl)urea
CID 122150088
N-(4-acetamidophenyl)-11-(2,5-dioxopyrrolidin-1-yl)undecanamide
CID 17035141
3-(2,5-dioxopyrrolidin-1-yl)-N-(4-methyl-3-nitrophenyl)propanamide
CID 29201494
N-[3-chloro-4-(2-methoxyethoxy)phenyl]-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 47067788
N-[4-chloro-3-(trifluoromethyl)phenyl]-4-(2,5-dioxopyrrolidin-1-yl)butanamide
CID 2219815
11-(2,5-dioxopyrrolidin-1-yl)-N-(4-fluorophenyl)undecanamide
CID 17035124
N-(3,4-difluorophenyl)-3-(2,5-dioxopyrrolidin-1-yl)propanamide
CID 9210364

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide?
The IUPAC name of 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide (CID 167745572) is 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide.
What is the SMILES notation for 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide?
The canonical SMILES for 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide is Cc1cc(NC(=O)CCCN2C(=O)CCC2=O)ccc1OC(C)C.
What is the InChIKey of 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide?
The InChIKey is LTLMVXZNKGCQMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O4/c1-12(2)24-15-7-6-14(11-13(15)3)19-16(21)5-4-10-20-17(22)8-9-18(20)23/h6-7,11-12H,4-5,8-10H2,1-3H3,(H,19,21).
What are the key properties of 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide?
4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide has a molecular weight of 332.40 g/mol, XLogP of 2.65, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dioxopyrrolidin-1-yl)-N-(3-methyl-4-propan-2-yloxyphenyl)butanamide is sourced from PubChem (CID 167745572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).