N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide

C16H18N2O4S — CID 34684530

IUPACN-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide
SMILESCOCc1ccccc1CNC(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H18N2O4S/c1-22-11-14-6-3-2-5-13(14)10-18-16(19)12-7-4-8-15(9-12)23(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyMIPOYPVGCNDICN-UHFFFAOYSA-N
MW334.40 g/mol
LogP1.41
Rot. Bonds6

About N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide

N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide (PubChem CID 34684530) has the molecular formula C16H18N2O4S and a molecular weight of 334.40 g/mol. Its IUPAC name is N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide.

Molecular Properties

Compound NameN-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide
PubChem CID34684530
Molecular FormulaC16H18N2O4S
Molecular Weight334.40 g/mol
Exact Mass334.10
IUPAC NameN-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide
SMILESCOCc1ccccc1CNC(=O)c1cccc(S(N)(=O)=O)c1
InChIInChI=1S/C16H18N2O4S/c1-22-11-14-6-3-2-5-13(14)10-18-16(19)12-7-4-8-15(9-12)23(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21)
InChIKeyMIPOYPVGCNDICN-UHFFFAOYSA-N
XLogP1.41
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.40
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602369
N-[[2-(methoxymethyl)phenyl]methyl]-3-(3-oxopiperazin-1-yl)sulfonylbenzamide
CID 30855899
N-ethyl-3-sulfamoylbenzamide
CID 43089872
4-(aminomethyl)-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 60924658
N-(3-methoxy-2-methylpropyl)-3-sulfamoylbenzamide
CID 48630521
N-[[2-(methoxymethyl)phenyl]methyl]-2-oxo-1H-pyridine-4-carboxamide
CID 103762844
3-fluoro-N-[[2-(methoxymethyl)phenyl]methyl]-4-methylbenzamide
CID 32604559
4-iodo-N-[[2-(methoxymethyl)phenyl]methyl]benzamide
CID 32602161
2-bromo-N-[[2-(methoxymethyl)phenyl]methyl]pyridine-4-carboxamide
CID 103752307
4-hydroxy-N-[[2-(methoxymethyl)phenyl]methyl]-3-nitrobenzamide
CID 99717489
3-(3-methoxypropylsulfamoyl)-N-[(2-methylphenyl)methyl]benzamide
CID 109063719
5-bromo-N-[[2-(methoxymethyl)phenyl]methyl]pyridine-3-carboxamide
CID 32602395

Frequently Asked Questions

What is the IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide?
The IUPAC name of N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide (CID 34684530) is N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide.
What is the SMILES notation for N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide?
The canonical SMILES for N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide is COCc1ccccc1CNC(=O)c1cccc(S(N)(=O)=O)c1.
What is the InChIKey of N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide?
The InChIKey is MIPOYPVGCNDICN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O4S/c1-22-11-14-6-3-2-5-13(14)10-18-16(19)12-7-4-8-15(9-12)23(17,20)21/h2-9H,10-11H2,1H3,(H,18,19)(H2,17,20,21).
What are the key properties of N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide?
N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide has a molecular weight of 334.40 g/mol, XLogP of 1.41, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(methoxymethyl)phenyl]methyl]-3-sulfamoylbenzamide is sourced from PubChem (CID 34684530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).