N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide

C21H22N4O4S — CID 163061940

IUPACN-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCC2Cn3cc(-c4ccccc4)nc3CO2)cc1
InChIInChI=1S/C21H22N4O4S/c1-15(26)23-17-7-9-19(10-8-17)30(27,28)22-11-18-12-25-13-20(24-21(25)14-29-18)16-5-3-2-4-6-16/h2-10,13,18,22H,11-12,14H2,1H3,(H,23,26)
InChIKeyWDPQEYATNKJGKN-UHFFFAOYSA-N
MW426.50 g/mol
LogP2.39
Rot. Bonds6

About N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide

N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide (PubChem CID 163061940) has the molecular formula C21H22N4O4S and a molecular weight of 426.50 g/mol. Its IUPAC name is N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide
PubChem CID163061940
Molecular FormulaC21H22N4O4S
Molecular Weight426.50 g/mol
Exact Mass426.14
IUPAC NameN-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide
SMILESCC(=O)Nc1ccc(S(=O)(=O)NCC2Cn3cc(-c4ccccc4)nc3CO2)cc1
InChIInChI=1S/C21H22N4O4S/c1-15(26)23-17-7-9-19(10-8-17)30(27,28)22-11-18-12-25-13-20(24-21(25)14-29-18)16-5-3-2-4-6-16/h2-10,13,18,22H,11-12,14H2,1H3,(H,23,26)
InChIKeyWDPQEYATNKJGKN-UHFFFAOYSA-N
XLogP2.39
TPSA102.32 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.50
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-ylmethylsulfamoyl)phenyl]acetamide
CID 162806660
N-[4-[[[(6S)-2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methylamino]methyl]phenyl]acetamide
CID 75367354
N-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methyl]propan-2-amine
CID 163083142
N-[[2-(4-methoxyphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methyl]-2-phenylacetamide
CID 162797942
N-[(1-methylindol-3-yl)methyl]-1-[2-(4-methylphenyl)-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl]methanamine
CID 162798839
4-(phenylsulfamoyl)-N-[4-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 55885317
N-[4-[2-(5-phenyl-1,2-oxazol-3-yl)ethylsulfamoyl]phenyl]acetamide
CID 110314714
N-[4-[(3-hydroxycyclopentyl)methylsulfamoyl]phenyl]acetamide
CID 103270149
N-[4-[4-[(1-acetylpiperidin-4-yl)methylsulfamoyl]phenyl]phenyl]acetamide
CID 166195615
N-[4-(1,2,3,4-tetrahydronaphthalen-1-ylmethylsulfamoyl)phenyl]acetamide
CID 42949923
2-(benzenesulfonamidomethyl)-1,4-oxazepane-4-carboxylic acid
CID 123828781
N-[4-(benzenesulfonamidomethyl)phenyl]acetamide
CID 32683830

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide (CID 163061940) is N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide is CC(=O)Nc1ccc(S(=O)(=O)NCC2Cn3cc(-c4ccccc4)nc3CO2)cc1.
What is the InChIKey of N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide?
The InChIKey is WDPQEYATNKJGKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N4O4S/c1-15(26)23-17-7-9-19(10-8-17)30(27,28)22-11-18-12-25-13-20(24-21(25)14-29-18)16-5-3-2-4-6-16/h2-10,13,18,22H,11-12,14H2,1H3,(H,23,26).
What are the key properties of N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide?
N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide has a molecular weight of 426.50 g/mol, XLogP of 2.39, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-phenyl-6,8-dihydro-5H-imidazo[2,1-c][1,4]oxazin-6-yl)methylsulfamoyl]phenyl]acetamide is sourced from PubChem (CID 163061940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).