2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide

C21H25FN2O4S — CID 15995932

IUPAC2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NC(=O)c1cc(S(=O)(=O)NC2CCCCC2C)ccc1F
InChIInChI=1S/C21H25FN2O4S/c1-14-7-3-4-8-18(14)24-29(26,27)15-11-12-17(22)16(13-15)21(25)23-19-9-5-6-10-20(19)28-2/h5-6,9-14,18,24H,3-4,7-8H2,1-2H3,(H,23,25)
InChIKeyOMAYMIWBCNKBAF-UHFFFAOYSA-N
MW420.51 g/mol
LogP3.94
Rot. Bonds6

About 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide

2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide (PubChem CID 15995932) has the molecular formula C21H25FN2O4S and a molecular weight of 420.51 g/mol. Its IUPAC name is 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide
PubChem CID15995932
Molecular FormulaC21H25FN2O4S
Molecular Weight420.51 g/mol
Exact Mass420.15
IUPAC Name2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide
SMILESCOc1ccccc1NC(=O)c1cc(S(=O)(=O)NC2CCCCC2C)ccc1F
InChIInChI=1S/C21H25FN2O4S/c1-14-7-3-4-8-18(14)24-29(26,27)15-11-12-17(22)16(13-15)21(25)23-19-9-5-6-10-20(19)28-2/h5-6,9-14,18,24H,3-4,7-8H2,1-2H3,(H,23,25)
InChIKeyOMAYMIWBCNKBAF-UHFFFAOYSA-N
XLogP3.94
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.51
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,5-dichlorophenyl)-2-fluoro-5-[(2-methylcyclohexyl)sulfamoyl]benzamide
CID 4190481
4-fluoro-3-methoxy-N-[(1S,2R)-2-methylcyclohexyl]benzenesulfonamide
CID 7389210
2-fluoro-5-[(2-methylcyclohexyl)sulfamoyl]benzoic acid
CID 43081703
2-fluoro-N-(2-methoxyphenyl)-5-(2-phenylethylsulfamoyl)benzamide
CID 5070664
5-[(3S)-1,1-dioxothiolan-3-yl]sulfonyl-2-fluoro-N-(2-methoxyphenyl)benzamide
CID 42364516
4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]-N-[2-(trifluoromethoxy)phenyl]benzamide
CID 46644366
5-(cyclohexylsulfamoyl)-N-(2-ethylphenyl)-2-fluorobenzamide
CID 4685317
3-[(2-methoxyphenyl)sulfamoyl]-N-[(1R,2R)-2-methylcyclohexyl]benzamide
CID 9164421
5-(cyclohexylsulfamoyl)-N-(2,3-dimethylphenyl)-2-fluorobenzamide
CID 4102001
N-(5-chloro-2-methoxyphenyl)-4-methoxy-3-[(2-methylcyclohexyl)sulfamoyl]benzamide
CID 42997457
5-cyclopentyloxy-2-fluoro-4-methoxy-N-(2-methoxyphenyl)benzamide
CID 22145771
N-(5-fluoro-6-methyl-2-pyridinyl)-5-[[(1S,2S)-2-hydroxycyclohexyl]sulfamoyl]-2-methoxybenzamide
CID 146256038

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide?
The IUPAC name of 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide (CID 15995932) is 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide.
What is the SMILES notation for 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide?
The canonical SMILES for 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide is COc1ccccc1NC(=O)c1cc(S(=O)(=O)NC2CCCCC2C)ccc1F.
What is the InChIKey of 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide?
The InChIKey is OMAYMIWBCNKBAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25FN2O4S/c1-14-7-3-4-8-18(14)24-29(26,27)15-11-12-17(22)16(13-15)21(25)23-19-9-5-6-10-20(19)28-2/h5-6,9-14,18,24H,3-4,7-8H2,1-2H3,(H,23,25).
What are the key properties of 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide?
2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide has a molecular weight of 420.51 g/mol, XLogP of 3.94, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-methoxyphenyl)-5-[(2-methylcyclohexyl)sulfamoyl]benzamide is sourced from PubChem (CID 15995932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).