2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide

C18H15ClN2O3S — CID 99951407

IUPAC2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)c(Cl)c1
InChIInChI=1S/C18H15ClN2O3S/c1-25(23,24)21-15-8-9-16(17(19)11-15)18(22)20-14-7-6-12-4-2-3-5-13(12)10-14/h2-11,21H,1H3,(H,20,22)
InChIKeyDWYBBKWCDCXGFU-UHFFFAOYSA-N
MW374.85 g/mol
LogP4.12
Rot. Bonds4

About 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide

2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide (PubChem CID 99951407) has the molecular formula C18H15ClN2O3S and a molecular weight of 374.85 g/mol. Its IUPAC name is 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide.

Molecular Properties

Compound Name2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
PubChem CID99951407
Molecular FormulaC18H15ClN2O3S
Molecular Weight374.85 g/mol
Exact Mass374.05
IUPAC Name2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide
SMILESCS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)c(Cl)c1
InChIInChI=1S/C18H15ClN2O3S/c1-25(23,24)21-15-8-9-16(17(19)11-15)18(22)20-14-7-6-12-4-2-3-5-13(12)10-14/h2-11,21H,1H3,(H,20,22)
InChIKeyDWYBBKWCDCXGFU-UHFFFAOYSA-N
XLogP4.12
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.85
LogP ≤ 54.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-acetamidophenyl)-2-chloro-4-(methanesulfonamido)benzamide
CID 28635588
2-chloro-N-(4-chloro-2-methylphenyl)-4-(methanesulfonamido)benzamide
CID 28580400
2-chloro-4-(methanesulfonamido)-N-[4-[(4-methylphenyl)sulfamoyl]phenyl]benzamide
CID 92684011
N-(4-acetamidophenyl)-2-chloro-5-(methanesulfonamido)benzamide
CID 30397176
2-chloro-N-(4-chlorophenyl)-5-(methanesulfonamido)benzamide
CID 92685896
2-chloro-4-(methanesulfonamido)-N-(4-piperidin-1-ylsulfonylphenyl)benzamide
CID 92681738
2-chloro-4-(methanesulfonamido)-N-(4-morpholin-4-ylphenyl)benzamide
CID 100522117
2-chloro-4-(methanesulfonamido)-N-(1-phenylpropyl)benzamide
CID 43876402
methyl 3-[[2-chloro-4-(methanesulfonamido)benzoyl]amino]-2-methylbenzoate
CID 99957500
4-(benzenesulfonamido)-2-chloro-N-(4-methylphenyl)benzamide
CID 43910172
2-chloro-4-(methanesulfonamido)-N-(2-methoxyethyl)benzamide
CID 38003506
4-(benzenesulfonamido)-2-chloro-N-[4-(phenylsulfamoyl)phenyl]benzamide
CID 99942022

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The IUPAC name of 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide (CID 99951407) is 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide.
What is the SMILES notation for 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The canonical SMILES for 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide is CS(=O)(=O)Nc1ccc(C(=O)Nc2ccc3ccccc3c2)c(Cl)c1.
What is the InChIKey of 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
The InChIKey is DWYBBKWCDCXGFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15ClN2O3S/c1-25(23,24)21-15-8-9-16(17(19)11-15)18(22)20-14-7-6-12-4-2-3-5-13(12)10-14/h2-11,21H,1H3,(H,20,22).
What are the key properties of 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide?
2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide has a molecular weight of 374.85 g/mol, XLogP of 4.12, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-(methanesulfonamido)-N-naphthalen-2-ylbenzamide is sourced from PubChem (CID 99951407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).