N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide

C18H17NO4S — CID 823335

IUPACN-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide
SMILESCOc1ccc(OC)c(NS(=O)(=O)c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H17NO4S/c1-22-15-8-10-18(23-2)17(12-15)19-24(20,21)16-9-7-13-5-3-4-6-14(13)11-16/h3-12,19H,1-2H3
InChIKeyCENXJRMWUXFKEH-UHFFFAOYSA-N
MW343.40 g/mol
LogP3.66
Rot. Bonds5

About N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide

N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide (PubChem CID 823335) has the molecular formula C18H17NO4S and a molecular weight of 343.40 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide
PubChem CID823335
Molecular FormulaC18H17NO4S
Molecular Weight343.40 g/mol
Exact Mass343.09
IUPAC NameN-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide
SMILESCOc1ccc(OC)c(NS(=O)(=O)c2ccc3ccccc3c2)c1
InChIInChI=1S/C18H17NO4S/c1-22-15-8-10-18(23-2)17(12-15)19-24(20,21)16-9-7-13-5-3-4-6-14(13)11-16/h3-12,19H,1-2H3
InChIKeyCENXJRMWUXFKEH-UHFFFAOYSA-N
XLogP3.66
TPSA64.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.40
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-hydroxy-2-methoxyphenyl)naphthalene-2-sulfonamide
CID 70792470
N-(5-chloro-2-methoxyphenyl)-6-methoxynaphthalene-2-sulfonamide
CID 100666504
N-(2,5-dimethoxyphenyl)-3,5-dimethoxybenzenesulfonamide
CID 24989180
N-(2,5-dimethoxyphenyl)-3-nitrobenzenesulfonamide
CID 2885763
N-[4-[(2,5-dimethoxyphenyl)sulfamoyl]phenyl]-3-iodo-4-methoxybenzenesulfonamide
CID 126412231
4-[(2,5-dimethoxyphenyl)sulfamoyl]benzoate
CID 4060147
4-(aminomethyl)-N-(2,5-dimethoxyphenyl)benzenesulfonamide;hydrochloride
CID 172999625
N-[2-methoxy-5-[(2-methoxyphenyl)sulfamoyl]phenyl]naphthalene-2-carboxamide
CID 24635874
methyl 4-methoxy-3-[(4-methoxyphenyl)sulfonylamino]benzoate
CID 3707700
N-(2,5-dimethoxyphenyl)-3-(hydrazinecarbonyl)benzenesulfonamide
CID 100657262
N-(2,4-dimethoxyphenyl)-4-phenoxybenzenesulfonamide
CID 46764272
N-(2-methylphenyl)naphthalene-2-sulfonamide
CID 3308551

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide?
The IUPAC name of N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide (CID 823335) is N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide?
The canonical SMILES for N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide is COc1ccc(OC)c(NS(=O)(=O)c2ccc3ccccc3c2)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide?
The InChIKey is CENXJRMWUXFKEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO4S/c1-22-15-8-10-18(23-2)17(12-15)19-24(20,21)16-9-7-13-5-3-4-6-14(13)11-16/h3-12,19H,1-2H3.
What are the key properties of N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide?
N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide has a molecular weight of 343.40 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)naphthalene-2-sulfonamide is sourced from PubChem (CID 823335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).