N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

C22H23FN4O3 — CID 69117628

IUPACN-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(-c3ccc(C4=NCCN4C)cc3)c(F)c2)C(=O)O1
InChIInChI=1S/C22H23FN4O3/c1-14(28)25-12-18-13-27(22(29)30-18)17-7-8-19(20(23)11-17)15-3-5-16(6-4-15)21-24-9-10-26(21)2/h3-8,11,18H,9-10,12-13H2,1-2H3,(H,25,28)
InChIKeyLGOFWWPZLBLOQW-UHFFFAOYSA-N
MW410.45 g/mol
LogP2.65
Rot. Bonds5

About N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 69117628) has the molecular formula C22H23FN4O3 and a molecular weight of 410.45 g/mol. Its IUPAC name is N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID69117628
Molecular FormulaC22H23FN4O3
Molecular Weight410.45 g/mol
Exact Mass410.18
IUPAC NameN-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(-c3ccc(C4=NCCN4C)cc3)c(F)c2)C(=O)O1
InChIInChI=1S/C22H23FN4O3/c1-14(28)25-12-18-13-27(22(29)30-18)17-7-8-19(20(23)11-17)15-3-5-16(6-4-15)21-24-9-10-26(21)2/h3-8,11,18H,9-10,12-13H2,1-2H3,(H,25,28)
InChIKeyLGOFWWPZLBLOQW-UHFFFAOYSA-N
XLogP2.65
TPSA74.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.45
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (CID 69117628) is N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NCC1CN(c2ccc(-c3ccc(C4=NCCN4C)cc3)c(F)c2)C(=O)O1.
What is the InChIKey of N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is LGOFWWPZLBLOQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN4O3/c1-14(28)25-12-18-13-27(22(29)30-18)17-7-8-19(20(23)11-17)15-3-5-16(6-4-15)21-24-9-10-26(21)2/h3-8,11,18H,9-10,12-13H2,1-2H3,(H,25,28).
What are the key properties of N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 410.45 g/mol, XLogP of 2.65, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[3-fluoro-4-[4-(1-methyl-4,5-dihydroimidazol-2-yl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 69117628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).