N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide

C17H21FN4O4 — CID 8571207

IUPACN-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
SMILESCCNC(=O)CNC(=O)CN1C(=O)N[C@](CC)(c2ccc(F)cc2)C1=O
InChIInChI=1S/C17H21FN4O4/c1-3-17(11-5-7-12(18)8-6-11)15(25)22(16(26)21-17)10-14(24)20-9-13(23)19-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,19,23)(H,20,24)(H,21,26)/t17-/m1/s1
InChIKeyQPRSUNQVVFSKPZ-QGZVFWFLSA-N
MW364.38 g/mol
LogP0.24
Rot. Bonds7

About N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide

N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide (PubChem CID 8571207) has the molecular formula C17H21FN4O4 and a molecular weight of 364.38 g/mol. Its IUPAC name is N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
PubChem CID8571207
Molecular FormulaC17H21FN4O4
Molecular Weight364.38 g/mol
Exact Mass364.15
IUPAC NameN-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
SMILESCCNC(=O)CNC(=O)CN1C(=O)N[C@](CC)(c2ccc(F)cc2)C1=O
InChIInChI=1S/C17H21FN4O4/c1-3-17(11-5-7-12(18)8-6-11)15(25)22(16(26)21-17)10-14(24)20-9-13(23)19-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,19,23)(H,20,24)(H,21,26)/t17-/m1/s1
InChIKeyQPRSUNQVVFSKPZ-QGZVFWFLSA-N
XLogP0.24
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 50.24
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The IUPAC name of N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide (CID 8571207) is N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide is CCNC(=O)CNC(=O)CN1C(=O)N[C@](CC)(c2ccc(F)cc2)C1=O.
What is the InChIKey of N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The InChIKey is QPRSUNQVVFSKPZ-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H21FN4O4/c1-3-17(11-5-7-12(18)8-6-11)15(25)22(16(26)21-17)10-14(24)20-9-13(23)19-4-2/h5-8H,3-4,9-10H2,1-2H3,(H,19,23)(H,20,24)(H,21,26)/t17-/m1/s1.
What are the key properties of N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide has a molecular weight of 364.38 g/mol, XLogP of 0.24, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[[2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide is sourced from PubChem (CID 8571207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).