2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide

C25H25N5O4 — CID 110207168

IUPAC2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide
SMILESCC(=O)Nc1cccc(N2C(=O)N[C@@H](CC(=O)NC3CCCc4c3[nH]c3ccccc43)C2=O)c1
InChIInChI=1S/C25H25N5O4/c1-14(31)26-15-6-4-7-16(12-15)30-24(33)21(29-25(30)34)13-22(32)27-20-11-5-9-18-17-8-2-3-10-19(17)28-23(18)20/h2-4,6-8,10,12,20-21,28H,5,9,11,13H2,1H3,(H,26,31)(H,27,32)(H,29,34)/t20?,21-/m0/s1
InChIKeyYMWFPLFDFQEREC-LBAQZLPGSA-N
MW459.51 g/mol
LogP3.13
Rot. Bonds5

About 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide

2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide (PubChem CID 110207168) has the molecular formula C25H25N5O4 and a molecular weight of 459.51 g/mol. Its IUPAC name is 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide.

Molecular Properties

Compound Name2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide
PubChem CID110207168
Molecular FormulaC25H25N5O4
Molecular Weight459.51 g/mol
Exact Mass459.19
IUPAC Name2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide
SMILESCC(=O)Nc1cccc(N2C(=O)N[C@@H](CC(=O)NC3CCCc4c3[nH]c3ccccc43)C2=O)c1
InChIInChI=1S/C25H25N5O4/c1-14(31)26-15-6-4-7-16(12-15)30-24(33)21(29-25(30)34)13-22(32)27-20-11-5-9-18-17-8-2-3-10-19(17)28-23(18)20/h2-4,6-8,10,12,20-21,28H,5,9,11,13H2,1H3,(H,26,31)(H,27,32)(H,29,34)/t20?,21-/m0/s1
InChIKeyYMWFPLFDFQEREC-LBAQZLPGSA-N
XLogP3.13
TPSA123.40 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500459.51
LogP ≤ 53.13
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

Analyze 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide 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

2-[(4S)-1-[2-(4-methoxyphenyl)ethyl]-2,5-dioxoimidazolidin-4-yl]-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 126418568
2-methoxy-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 124604925
2-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 99755071
3-[(4S)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(1S)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]propanamide
CID 124879536
3-[(4S)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]propanamide
CID 124879535
2-(3,4-dimethoxyphenyl)-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 97496764
N-[(1S)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]cyclopropanecarboxamide
CID 124879022
3-(4-oxo-3H-quinazolin-2-yl)-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)propanamide
CID 135639778
1-methyl-2-oxo-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)quinoline-4-carboxamide
CID 75489945
N-[(1R)-8-chloro-2,3,4,9-tetrahydro-1H-carbazol-1-yl]-2-[(4R)-1-(furan-2-ylmethyl)-2,5-dioxoimidazolidin-4-yl]acetamide
CID 126418717
2-(7,8-dimethoxy-2-oxo-1H-3-benzazepin-3-yl)-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]acetamide
CID 125427756
3-methyl-4-oxo-N-[(1R)-2,3,4,9-tetrahydro-1H-carbazol-1-yl]phthalazine-1-carboxamide
CID 99755073

Frequently Asked Questions

What is the IUPAC name of 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide?
The IUPAC name of 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide (CID 110207168) is 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide.
What is the SMILES notation for 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide?
The canonical SMILES for 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide is CC(=O)Nc1cccc(N2C(=O)N[C@@H](CC(=O)NC3CCCc4c3[nH]c3ccccc43)C2=O)c1.
What is the InChIKey of 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide?
The InChIKey is YMWFPLFDFQEREC-LBAQZLPGSA-N. The full InChI is InChI=1S/C25H25N5O4/c1-14(31)26-15-6-4-7-16(12-15)30-24(33)21(29-25(30)34)13-22(32)27-20-11-5-9-18-17-8-2-3-10-19(17)28-23(18)20/h2-4,6-8,10,12,20-21,28H,5,9,11,13H2,1H3,(H,26,31)(H,27,32)(H,29,34)/t20?,21-/m0/s1.
What are the key properties of 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide?
2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide has a molecular weight of 459.51 g/mol, XLogP of 3.13, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4S)-1-(3-acetamidophenyl)-2,5-dioxoimidazolidin-4-yl]-N-(2,3,4,9-tetrahydro-1H-carbazol-1-yl)acetamide is sourced from PubChem (CID 110207168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).