2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide

C15H14F2N2O3S — CID 32535953

IUPAC2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide
SMILESCS(=O)(=O)Nc1cccc(CNC(=O)c2c(F)cccc2F)c1
InChIInChI=1S/C15H14F2N2O3S/c1-23(21,22)19-11-5-2-4-10(8-11)9-18-15(20)14-12(16)6-3-7-13(14)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyWIDCVYHJQKRTSZ-UHFFFAOYSA-N
MW340.35 g/mol
LogP2.27
Rot. Bonds5

About 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide

2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide (PubChem CID 32535953) has the molecular formula C15H14F2N2O3S and a molecular weight of 340.35 g/mol. Its IUPAC name is 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide
PubChem CID32535953
Molecular FormulaC15H14F2N2O3S
Molecular Weight340.35 g/mol
Exact Mass340.07
IUPAC Name2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide
SMILESCS(=O)(=O)Nc1cccc(CNC(=O)c2c(F)cccc2F)c1
InChIInChI=1S/C15H14F2N2O3S/c1-23(21,22)19-11-5-2-4-10(8-11)9-18-15(20)14-12(16)6-3-7-13(14)17/h2-8,19H,9H2,1H3,(H,18,20)
InChIKeyWIDCVYHJQKRTSZ-UHFFFAOYSA-N
XLogP2.27
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.35
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-2-iodo-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide
CID 46453145
2-chloro-N-[(3-fluorophenyl)methyl]-5-(methanesulfonamido)benzamide
CID 53283727
(2R)-2-amino-N-[[3-(methanesulfonamido)phenyl]methyl]propanamide
CID 119277174
N-[[3-(bromomethyl)phenyl]methyl]-2,6-difluorobenzamide
CID 114313059
N-[[3-(methanesulfonamido)phenyl]methyl]-5-methylpyrazine-2-carboxamide
CID 46533069
2-(4-bromobenzoyl)-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide
CID 32535159
N-[[3-(methanesulfonamido)phenyl]methyl]-5-propyl-1H-pyrazole-3-carboxamide
CID 32535295
1-[[3-(methanesulfonamido)phenyl]methyl]-3-[(3-methoxyphenyl)methyl]urea
CID 16608876
6-(dimethylamino)-N-[[3-(methanesulfonamido)phenyl]methyl]pyridine-3-carboxamide
CID 32536301
2,6-difluoro-N-[3-(methylaminomethyl)phenyl]benzamide
CID 43601976
1-[[3-(methanesulfonamido)phenyl]methyl]-3-(3-methylbutyl)urea
CID 41465627
2-[[2-[3-(methanesulfonamido)phenyl]acetyl]amino]acetic acid
CID 119350188

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide (CID 32535953) is 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide is CS(=O)(=O)Nc1cccc(CNC(=O)c2c(F)cccc2F)c1.
What is the InChIKey of 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide?
The InChIKey is WIDCVYHJQKRTSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2N2O3S/c1-23(21,22)19-11-5-2-4-10(8-11)9-18-15(20)14-12(16)6-3-7-13(14)17/h2-8,19H,9H2,1H3,(H,18,20).
What are the key properties of 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide?
2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide has a molecular weight of 340.35 g/mol, XLogP of 2.27, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[[3-(methanesulfonamido)phenyl]methyl]benzamide is sourced from PubChem (CID 32535953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).