3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide

C28H28N4O3 — CID 51815621

IUPAC3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CC[C@H]3NC(=O)N([C@@H](C)c4ccccc4)C3=O)ccc21
InChIInChI=1S/C28H28N4O3/c1-3-31-24-12-8-7-11-21(24)22-17-20(13-15-25(22)31)29-26(33)16-14-23-27(34)32(28(35)30-23)18(2)19-9-5-4-6-10-19/h4-13,15,17-18,23H,3,14,16H2,1-2H3,(H,29,33)(H,30,35)/t18-,23+/m0/s1
InChIKeyNBBYYIDIRDSHCV-FDDCHVKYSA-N
MW468.56 g/mol
LogP5.21
Rot. Bonds7

About 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide

3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide (PubChem CID 51815621) has the molecular formula C28H28N4O3 and a molecular weight of 468.56 g/mol. Its IUPAC name is 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide.

Molecular Properties

Compound Name3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide
PubChem CID51815621
Molecular FormulaC28H28N4O3
Molecular Weight468.56 g/mol
Exact Mass468.22
IUPAC Name3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide
SMILESCCn1c2ccccc2c2cc(NC(=O)CC[C@H]3NC(=O)N([C@@H](C)c4ccccc4)C3=O)ccc21
InChIInChI=1S/C28H28N4O3/c1-3-31-24-12-8-7-11-21(24)22-17-20(13-15-25(22)31)29-26(33)16-14-23-27(34)32(28(35)30-23)18(2)19-9-5-4-6-10-19/h4-13,15,17-18,23H,3,14,16H2,1-2H3,(H,29,33)(H,30,35)/t18-,23+/m0/s1
InChIKeyNBBYYIDIRDSHCV-FDDCHVKYSA-N
XLogP5.21
TPSA83.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500468.56
LogP ≤ 55.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide?
The IUPAC name of 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide (CID 51815621) is 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide.
What is the SMILES notation for 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide?
The canonical SMILES for 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide is CCn1c2ccccc2c2cc(NC(=O)CC[C@H]3NC(=O)N([C@@H](C)c4ccccc4)C3=O)ccc21.
What is the InChIKey of 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide?
The InChIKey is NBBYYIDIRDSHCV-FDDCHVKYSA-N. The full InChI is InChI=1S/C28H28N4O3/c1-3-31-24-12-8-7-11-21(24)22-17-20(13-15-25(22)31)29-26(33)16-14-23-27(34)32(28(35)30-23)18(2)19-9-5-4-6-10-19/h4-13,15,17-18,23H,3,14,16H2,1-2H3,(H,29,33)(H,30,35)/t18-,23+/m0/s1.
What are the key properties of 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide?
3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide has a molecular weight of 468.56 g/mol, XLogP of 5.21, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4R)-2,5-dioxo-1-[(1S)-1-phenylethyl]imidazolidin-4-yl]-N-(9-ethylcarbazol-3-yl)propanamide is sourced from PubChem (CID 51815621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).