N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide

C10H11F2N3O3 — CID 43089723

IUPACN-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide
SMILESNC(=O)NC(=O)CNc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H11F2N3O3/c11-9(12)18-7-3-1-6(2-4-7)14-5-8(16)15-10(13)17/h1-4,9,14H,5H2,(H3,13,15,16,17)
InChIKeyGGPJVOGOFNRDMV-UHFFFAOYSA-N
MW259.21 g/mol
LogP0.89
Rot. Bonds5

About N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide

N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide (PubChem CID 43089723) has the molecular formula C10H11F2N3O3 and a molecular weight of 259.21 g/mol. Its IUPAC name is N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide.

Molecular Properties

Compound NameN-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide
PubChem CID43089723
Molecular FormulaC10H11F2N3O3
Molecular Weight259.21 g/mol
Exact Mass259.08
IUPAC NameN-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide
SMILESNC(=O)NC(=O)CNc1ccc(OC(F)F)cc1
InChIInChI=1S/C10H11F2N3O3/c11-9(12)18-7-3-1-6(2-4-7)14-5-8(16)15-10(13)17/h1-4,9,14H,5H2,(H3,13,15,16,17)
InChIKeyGGPJVOGOFNRDMV-UHFFFAOYSA-N
XLogP0.89
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.21
LogP ≤ 50.89
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[4-(difluoromethoxy)anilino]-1-piperidin-1-ylethanone
CID 43217862
N-cycloheptyl-2-[4-(difluoromethoxy)anilino]acetamide
CID 47010791
2-[4-(difluoromethoxy)anilino]-1-(4-methylpiperazin-1-yl)ethanone
CID 43217887
4-(carbamoylamino)-N-[4-(difluoromethoxy)phenyl]benzamide
CID 26027108
2-[4-(difluoromethoxy)anilino]-N-(3-phenylpropyl)acetamide
CID 47007122
N-carbamoyl-2-(4-cyanoanilino)acetamide
CID 26507718
N-(1-cyanocyclohexyl)-2-[4-(difluoromethoxy)anilino]acetamide
CID 36586094
2-[4-(difluoromethoxy)anilino]-N-(2,5-dimethoxyphenyl)acetamide
CID 36585879
N-[4-(difluoromethoxy)phenyl]-2-(3-fluoroanilino)acetamide
CID 9098936
(2R)-1-[4-(difluoromethoxy)anilino]propan-2-ol
CID 106931834
4-[[4-(difluoromethoxy)benzoyl]amino]benzamide
CID 842852
4-[4-(difluoromethoxy)anilino]-N-methylbutanamide
CID 63892048

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide?
The IUPAC name of N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide (CID 43089723) is N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide.
What is the SMILES notation for N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide?
The canonical SMILES for N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide is NC(=O)NC(=O)CNc1ccc(OC(F)F)cc1.
What is the InChIKey of N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide?
The InChIKey is GGPJVOGOFNRDMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2N3O3/c11-9(12)18-7-3-1-6(2-4-7)14-5-8(16)15-10(13)17/h1-4,9,14H,5H2,(H3,13,15,16,17).
What are the key properties of N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide?
N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide has a molecular weight of 259.21 g/mol, XLogP of 0.89, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-[4-(difluoromethoxy)anilino]acetamide is sourced from PubChem (CID 43089723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).