N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide

C15H13F3N2O — CID 63667393

IUPACN-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide
SMILESCC(=O)Nc1cc(NCc2cccc(F)c2F)ccc1F
InChIInChI=1S/C15H13F3N2O/c1-9(21)20-14-7-11(5-6-12(14)16)19-8-10-3-2-4-13(17)15(10)18/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyGEVRVJIFVAXPJC-UHFFFAOYSA-N
MW294.28 g/mol
LogP3.67
Rot. Bonds4

About N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide

N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide (PubChem CID 63667393) has the molecular formula C15H13F3N2O and a molecular weight of 294.28 g/mol. Its IUPAC name is N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide.

Molecular Properties

Compound NameN-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide
PubChem CID63667393
Molecular FormulaC15H13F3N2O
Molecular Weight294.28 g/mol
Exact Mass294.10
IUPAC NameN-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide
SMILESCC(=O)Nc1cc(NCc2cccc(F)c2F)ccc1F
InChIInChI=1S/C15H13F3N2O/c1-9(21)20-14-7-11(5-6-12(14)16)19-8-10-3-2-4-13(17)15(10)18/h2-7,19H,8H2,1H3,(H,20,21)
InChIKeyGEVRVJIFVAXPJC-UHFFFAOYSA-N
XLogP3.67
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.28
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]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

N-[3-[(2,3-difluorophenyl)methylamino]phenyl]acetamide
CID 43425139
N-[5-[(2-aminophenyl)methylamino]-2-fluorophenyl]acetamide
CID 66417660
N-[2-fluoro-5-[(2,4,5-trifluorophenyl)methylamino]phenyl]acetamide
CID 75469999
N-[5-[(2,4-difluorophenyl)methylamino]-2-fluorophenyl]acetamide
CID 60928628
N-[5-[(2,4-dihydroxyphenyl)methylamino]-2-fluorophenyl]acetamide
CID 60928497
N-[5-[(5-bromo-2-fluorophenyl)methylamino]-2-fluorophenyl]acetamide
CID 60927782
N-[2-[(3,4-difluoroanilino)methyl]phenyl]acetamide
CID 66385222
N-[5-[(3-chlorophenyl)methylamino]-2-fluorophenyl]acetamide
CID 60928498
methyl 5-[(2,3-difluorophenyl)methylamino]-2-fluorobenzoate
CID 63667213
N-[2-fluoro-5-[(1-methylpyrrol-2-yl)methylamino]phenyl]acetamide
CID 55039179
4-[(2,3-difluorophenyl)methylamino]-2-fluorophenol
CID 64795401
N-[2-fluoro-5-(2-methylpropylamino)phenyl]acetamide
CID 60928010

Frequently Asked Questions

What is the IUPAC name of N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide?
The IUPAC name of N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide (CID 63667393) is N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide.
What is the SMILES notation for N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide?
The canonical SMILES for N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide is CC(=O)Nc1cc(NCc2cccc(F)c2F)ccc1F.
What is the InChIKey of N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide?
The InChIKey is GEVRVJIFVAXPJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13F3N2O/c1-9(21)20-14-7-11(5-6-12(14)16)19-8-10-3-2-4-13(17)15(10)18/h2-7,19H,8H2,1H3,(H,20,21).
What are the key properties of N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide?
N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide has a molecular weight of 294.28 g/mol, XLogP of 3.67, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(2,3-difluorophenyl)methylamino]-2-fluorophenyl]acetamide is sourced from PubChem (CID 63667393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).