N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide

C18H18FN3O4 — CID 52512582

IUPACN-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccccc3F)C2=O)o1
InChIInChI=1S/C18H18FN3O4/c1-11-7-8-14(26-11)18(2)16(24)22(17(25)21-18)10-15(23)20-9-12-5-3-4-6-13(12)19/h3-8H,9-10H2,1-2H3,(H,20,23)(H,21,25)/t18-/m1/s1
InChIKeyIWCAWAGHCJDLBQ-GOSISDBHSA-N
MW359.36 g/mol
LogP1.81
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide

N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide (PubChem CID 52512582) has the molecular formula C18H18FN3O4 and a molecular weight of 359.36 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide
PubChem CID52512582
Molecular FormulaC18H18FN3O4
Molecular Weight359.36 g/mol
Exact Mass359.13
IUPAC NameN-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide
SMILESCc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccccc3F)C2=O)o1
InChIInChI=1S/C18H18FN3O4/c1-11-7-8-14(26-11)18(2)16(24)22(17(25)21-18)10-15(23)20-9-12-5-3-4-6-13(12)19/h3-8H,9-10H2,1-2H3,(H,20,23)(H,21,25)/t18-/m1/s1
InChIKeyIWCAWAGHCJDLBQ-GOSISDBHSA-N
XLogP1.81
TPSA91.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.36
LogP ≤ 51.81
H-Bond Donors ≤ 52
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-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide (CID 52512582) is N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide is Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NCc3ccccc3F)C2=O)o1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide?
The InChIKey is IWCAWAGHCJDLBQ-GOSISDBHSA-N. The full InChI is InChI=1S/C18H18FN3O4/c1-11-7-8-14(26-11)18(2)16(24)22(17(25)21-18)10-15(23)20-9-12-5-3-4-6-13(12)19/h3-8H,9-10H2,1-2H3,(H,20,23)(H,21,25)/t18-/m1/s1.
What are the key properties of N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide?
N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide has a molecular weight of 359.36 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-2-[(4R)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide is sourced from PubChem (CID 52512582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).