2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

C24H20F2N4O5 — CID 26009625

IUPAC2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESC[C@]1(c2ccc(F)c(F)c2)NC(=O)N(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C1=O
InChIInChI=1S/C24H20F2N4O5/c1-24(14-8-9-17(25)18(26)11-14)22(33)30(23(34)29-24)13-20(31)28-19-7-3-2-6-16(19)21(32)27-12-15-5-4-10-35-15/h2-11H,12-13H2,1H3,(H,27,32)(H,28,31)(H,29,34)/t24-/m1/s1
InChIKeyXBFXIAVZSZWNPG-XMMPIXPASA-N
MW482.44 g/mol
LogP2.89
Rot. Bonds7

About 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide

2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (PubChem CID 26009625) has the molecular formula C24H20F2N4O5 and a molecular weight of 482.44 g/mol. Its IUPAC name is 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
PubChem CID26009625
Molecular FormulaC24H20F2N4O5
Molecular Weight482.44 g/mol
Exact Mass482.14
IUPAC Name2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide
SMILESC[C@]1(c2ccc(F)c(F)c2)NC(=O)N(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C1=O
InChIInChI=1S/C24H20F2N4O5/c1-24(14-8-9-17(25)18(26)11-14)22(33)30(23(34)29-24)13-20(31)28-19-7-3-2-6-16(19)21(32)27-12-15-5-4-10-35-15/h2-11H,12-13H2,1H3,(H,27,32)(H,28,31)(H,29,34)/t24-/m1/s1
InChIKeyXBFXIAVZSZWNPG-XMMPIXPASA-N
XLogP2.89
TPSA120.75 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms35
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500482.44
LogP ≤ 52.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The IUPAC name of 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide (CID 26009625) is 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide.
What is the SMILES notation for 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The canonical SMILES for 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is C[C@]1(c2ccc(F)c(F)c2)NC(=O)N(CC(=O)Nc2ccccc2C(=O)NCc2ccco2)C1=O.
What is the InChIKey of 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
The InChIKey is XBFXIAVZSZWNPG-XMMPIXPASA-N. The full InChI is InChI=1S/C24H20F2N4O5/c1-24(14-8-9-17(25)18(26)11-14)22(33)30(23(34)29-24)13-20(31)28-19-7-3-2-6-16(19)21(32)27-12-15-5-4-10-35-15/h2-11H,12-13H2,1H3,(H,27,32)(H,28,31)(H,29,34)/t24-/m1/s1.
What are the key properties of 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide?
2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide has a molecular weight of 482.44 g/mol, XLogP of 2.89, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-[(4R)-4-(3,4-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]-N-(furan-2-ylmethyl)benzamide is sourced from PubChem (CID 26009625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).