N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide

C12H15FN4O2 — CID 62492016

IUPACN-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
SMILESCN1CCN(CC(=O)Nc2ccc(F)c(N)c2)C1=O
InChIInChI=1S/C12H15FN4O2/c1-16-4-5-17(12(16)19)7-11(18)15-8-2-3-9(13)10(14)6-8/h2-3,6H,4-5,7,14H2,1H3,(H,15,18)
InChIKeyZILVYALQHWCZMX-UHFFFAOYSA-N
MW266.28 g/mol
LogP0.71
Rot. Bonds3

About N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide

N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide (PubChem CID 62492016) has the molecular formula C12H15FN4O2 and a molecular weight of 266.28 g/mol. Its IUPAC name is N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
PubChem CID62492016
Molecular FormulaC12H15FN4O2
Molecular Weight266.28 g/mol
Exact Mass266.12
IUPAC NameN-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
SMILESCN1CCN(CC(=O)Nc2ccc(F)c(N)c2)C1=O
InChIInChI=1S/C12H15FN4O2/c1-16-4-5-17(12(16)19)7-11(18)15-8-2-3-9(13)10(14)6-8/h2-3,6H,4-5,7,14H2,1H3,(H,15,18)
InChIKeyZILVYALQHWCZMX-UHFFFAOYSA-N
XLogP0.71
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.28
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-4-fluorophenyl)-2-(4-hydroxy-4-methylpiperidin-1-yl)acetamide
CID 81097272
N-(3-amino-4-fluorophenyl)-2-(4-oxo-1-pyridinyl)acetamide
CID 62880823
N-(3-amino-2-methylphenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
CID 55078174
N-(2-amino-6-methylphenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
CID 62490459
N-(4-amino-2,6-dichlorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide
CID 62491302
N-(3-amino-4-fluorophenyl)-2-(2,6-dimethylmorpholin-4-yl)acetamide
CID 16779490
N-(3-amino-4-fluorophenyl)-2-(1,4-thiazepan-4-yl)acetamide
CID 61418614
N-(3-amino-4-fluorophenyl)-3-(4-methylpiperidin-1-yl)propanamide
CID 16778601
N-(3-amino-4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 28995368
N-(3-amino-4-fluorophenyl)-2-(3-hydroxybutan-2-ylsulfanyl)acetamide
CID 107770467
N-(3-amino-4-methylphenyl)-2-(4-methyl-2,5-dioxopiperazin-1-yl)acetamide
CID 79936948
N-(2-amino-4-chlorophenyl)-3-(3-methyl-2-oxoimidazolidin-1-yl)propanamide
CID 62490811

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide (CID 62492016) is N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide is CN1CCN(CC(=O)Nc2ccc(F)c(N)c2)C1=O.
What is the InChIKey of N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
The InChIKey is ZILVYALQHWCZMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15FN4O2/c1-16-4-5-17(12(16)19)7-11(18)15-8-2-3-9(13)10(14)6-8/h2-3,6H,4-5,7,14H2,1H3,(H,15,18).
What are the key properties of N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide?
N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide has a molecular weight of 266.28 g/mol, XLogP of 0.71, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-fluorophenyl)-2-(3-methyl-2-oxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 62492016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).