N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

C22H24N4O3 — CID 90990202

IUPACN-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(C34CC3CN(c3ccncc3)C4)cc2)C(=O)O1
InChIInChI=1S/C22H24N4O3/c1-15(27)24-11-20-13-26(21(28)29-20)19-4-2-16(3-5-19)22-10-17(22)12-25(14-22)18-6-8-23-9-7-18/h2-9,17,20H,10-14H2,1H3,(H,24,27)
InChIKeyDHEJXDZNYGKGFS-UHFFFAOYSA-N
MW392.46 g/mol
LogP2.32
Rot. Bonds5

About N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 90990202) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID90990202
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(C34CC3CN(c3ccncc3)C4)cc2)C(=O)O1
InChIInChI=1S/C22H24N4O3/c1-15(27)24-11-20-13-26(21(28)29-20)19-4-2-16(3-5-19)22-10-17(22)12-25(14-22)18-6-8-23-9-7-18/h2-9,17,20H,10-14H2,1H3,(H,24,27)
InChIKeyDHEJXDZNYGKGFS-UHFFFAOYSA-N
XLogP2.32
TPSA74.77 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide with MolForge

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Related Compounds

N-[[3-[4-(3-acetyl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 75305852
N-[[3-[4-[(1S,5R)-3-azabicyclo[3.1.0]hexan-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 67981345
[2-[1-[4-[5-(acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]phenyl]-3-azabicyclo[3.1.0]hexan-3-yl]-2-oxoethyl] ethyl carbonate
CID 75305914
N-[[(5S)-2-oxo-3-(4-pyridin-3-ylphenyl)-1,3-oxazolidin-5-yl]methyl]acetamide
CID 14987829
N-[[3-[4-(5,6-dihydro-1,2,4-oxadiazin-4-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 75095689
N-[[3-[4-(4-hydroxypiperidin-1-yl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 68698825
N-[[(5R)-3-[4-(hydroxymethyl)phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 54472628
N-[[3-(3-chloro-4-pyridin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 19418145
N-[[2-oxo-3-(4-piperazin-1-ylphenyl)-1,3-oxazolidin-5-yl]methyl]acetamide
CID 21462605
N-[[(5S)-3-[4-[(1S,5R)-6-cyano-3-methyl-3-azabicyclo[3.1.0]hexan-6-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 11772613
N-[[3-(3-fluoro-4-pyridin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 10381901
N-[[(5S)-3-[4-[4-(3-nitro-2-pyridinyl)piperazin-1-yl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 142671637

Frequently Asked Questions

What is the IUPAC name of N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide (CID 90990202) is N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NCC1CN(c2ccc(C34CC3CN(c3ccncc3)C4)cc2)C(=O)O1.
What is the InChIKey of N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is DHEJXDZNYGKGFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-15(27)24-11-20-13-26(21(28)29-20)19-4-2-16(3-5-19)22-10-17(22)12-25(14-22)18-6-8-23-9-7-18/h2-9,17,20H,10-14H2,1H3,(H,24,27).
What are the key properties of N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 392.46 g/mol, XLogP of 2.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-oxo-3-[4-(3-pyridin-4-yl-3-azabicyclo[3.1.0]hexan-1-yl)phenyl]-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 90990202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).