N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide

C22H24N2O3S — CID 18285223

IUPACN-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3c2)ccc1C
InChIInChI=1S/C22H24N2O3S/c1-4-24(5-2)28(26,27)21-15-20(13-10-16(21)3)23-22(25)19-12-11-17-8-6-7-9-18(17)14-19/h6-15H,4-5H2,1-3H3,(H,23,25)
InChIKeyRNAIWBBBTIVRGO-UHFFFAOYSA-N
MW396.51 g/mol
LogP4.43
Rot. Bonds6

About N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide

N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide (PubChem CID 18285223) has the molecular formula C22H24N2O3S and a molecular weight of 396.51 g/mol. Its IUPAC name is N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide.

Molecular Properties

Compound NameN-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide
PubChem CID18285223
Molecular FormulaC22H24N2O3S
Molecular Weight396.51 g/mol
Exact Mass396.15
IUPAC NameN-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3c2)ccc1C
InChIInChI=1S/C22H24N2O3S/c1-4-24(5-2)28(26,27)21-15-20(13-10-16(21)3)23-22(25)19-12-11-17-8-6-7-9-18(17)14-19/h6-15H,4-5H2,1-3H3,(H,23,25)
InChIKeyRNAIWBBBTIVRGO-UHFFFAOYSA-N
XLogP4.43
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.51
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[3-(diethylsulfamoyl)-4-methylphenyl]carbamoyl]benzoic acid
CID 45337189
N-[3-(diethylsulfamoyl)phenyl]naphthalene-2-carboxamide
CID 7760022
3-(diethylsulfamoyl)-4-methyl-N-(4-methylphenyl)benzamide
CID 2876161
3-(diethylsulfamoyl)-4-methyl-N-(3-methylphenyl)benzamide
CID 2540395
N-[3-(diethylsulfamoyl)-4-methylphenyl]-4-(trifluoromethyl)benzamide
CID 7688995
4-butoxy-N-[3-(diethylsulfamoyl)-4-methylphenyl]benzamide
CID 18205717
N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-(difluoromethoxy)benzamide
CID 26521263
3-(diethylsulfamoyl)-N-(3-ethylphenyl)-4-methylbenzamide
CID 26736506
N-[3-(diethylsulfamoyl)-4-methylphenyl]-3-(propan-2-ylsulfamoyl)benzamide
CID 30880575
2-amino-N-[3-(diethylsulfamoyl)-4-methylphenyl]benzamide
CID 119943661
N-[3-(diethylsulfamoyl)-4-methylphenyl]-2,3-dimethyl-1H-indole-5-carboxamide
CID 26759503
N-[3-(diethylsulfamoyl)-4-methylphenyl]-1,3-benzothiazole-6-carboxamide
CID 9101706

Frequently Asked Questions

What is the IUPAC name of N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide?
The IUPAC name of N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide (CID 18285223) is N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide.
What is the SMILES notation for N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide?
The canonical SMILES for N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide is CCN(CC)S(=O)(=O)c1cc(NC(=O)c2ccc3ccccc3c2)ccc1C.
What is the InChIKey of N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide?
The InChIKey is RNAIWBBBTIVRGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3S/c1-4-24(5-2)28(26,27)21-15-20(13-10-16(21)3)23-22(25)19-12-11-17-8-6-7-9-18(17)14-19/h6-15H,4-5H2,1-3H3,(H,23,25).
What are the key properties of N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide?
N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide has a molecular weight of 396.51 g/mol, XLogP of 4.43, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(diethylsulfamoyl)-4-methylphenyl]naphthalene-2-carboxamide is sourced from PubChem (CID 18285223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).