2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide

C14H12FN5O3S — CID 30550988

IUPAC2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2nncs2)C1=O
InChIInChI=1S/C14H12FN5O3S/c1-14(8-2-4-9(15)5-3-8)11(22)20(13(23)18-14)6-10(21)17-12-19-16-7-24-12/h2-5,7H,6H2,1H3,(H,18,23)(H,17,19,21)/t14-/m1/s1
InChIKeyTUTVPYCPISJFGW-CQSZACIVSA-N
MW349.35 g/mol
LogP1.08
Rot. Bonds4

About 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide

2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide (PubChem CID 30550988) has the molecular formula C14H12FN5O3S and a molecular weight of 349.35 g/mol. Its IUPAC name is 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide
PubChem CID30550988
Molecular FormulaC14H12FN5O3S
Molecular Weight349.35 g/mol
Exact Mass349.06
IUPAC Name2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide
SMILESC[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2nncs2)C1=O
InChIInChI=1S/C14H12FN5O3S/c1-14(8-2-4-9(15)5-3-8)11(22)20(13(23)18-14)6-10(21)17-12-19-16-7-24-12/h2-5,7H,6H2,1H3,(H,18,23)(H,17,19,21)/t14-/m1/s1
InChIKeyTUTVPYCPISJFGW-CQSZACIVSA-N
XLogP1.08
TPSA104.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.35
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(4-fluorophenyl)-2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2581954
N-(2,5-difluorophenyl)-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51250071
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[5-(4-propan-2-ylphenyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 55511480
N-[4-(2,5-difluorophenyl)-1,3-thiazol-2-yl]-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 43042841
2-[(4R)-4-(4-tert-butylphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 2084864
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 46671942
N-[4-[[2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetyl]amino]phenyl]-2-methylpropanamide
CID 46513573
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(6-methyl-2-pyridinyl)acetamide
CID 43042915
N-[4-(2,4-dichlorophenyl)-1,3-thiazol-2-yl]-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 43042831
N-(3-fluoro-4-methylphenyl)-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51250072
2-[(4S)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,5-difluorophenyl)acetamide
CID 7240396
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[4-(1,3-thiazol-2-yl)phenyl]acetamide
CID 18279498

Frequently Asked Questions

What is the IUPAC name of 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The IUPAC name of 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide (CID 30550988) is 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide.
What is the SMILES notation for 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The canonical SMILES for 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide is C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)Nc2nncs2)C1=O.
What is the InChIKey of 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide?
The InChIKey is TUTVPYCPISJFGW-CQSZACIVSA-N. The full InChI is InChI=1S/C14H12FN5O3S/c1-14(8-2-4-9(15)5-3-8)11(22)20(13(23)18-14)6-10(21)17-12-19-16-7-24-12/h2-5,7H,6H2,1H3,(H,18,23)(H,17,19,21)/t14-/m1/s1.
What are the key properties of 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide?
2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide has a molecular weight of 349.35 g/mol, XLogP of 1.08, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(1,3,4-thiadiazol-2-yl)acetamide is sourced from PubChem (CID 30550988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).