N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide

C24H24N2O3S — CID 24679131

IUPACN-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide
SMILESO=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H24N2O3S/c27-24(25-21-10-11-21)19-7-5-17(6-8-19)16-26(22-12-13-22)30(28,29)23-14-9-18-3-1-2-4-20(18)15-23/h1-9,14-15,21-22H,10-13,16H2,(H,25,27)
InChIKeyYIJYLYGSONUAQS-UHFFFAOYSA-N
MW420.53 g/mol
LogP4.09
Rot. Bonds7

About N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide

N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide (PubChem CID 24679131) has the molecular formula C24H24N2O3S and a molecular weight of 420.53 g/mol. Its IUPAC name is N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide.

Molecular Properties

Compound NameN-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide
PubChem CID24679131
Molecular FormulaC24H24N2O3S
Molecular Weight420.53 g/mol
Exact Mass420.15
IUPAC NameN-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide
SMILESO=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C24H24N2O3S/c27-24(25-21-10-11-21)19-7-5-17(6-8-19)16-26(22-12-13-22)30(28,29)23-14-9-18-3-1-2-4-20(18)15-23/h1-9,14-15,21-22H,10-13,16H2,(H,25,27)
InChIKeyYIJYLYGSONUAQS-UHFFFAOYSA-N
XLogP4.09
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.53
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]-N-methylbenzamide
CID 24679199
N-cyclopropyl-4-[[cyclopropyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)amino]methyl]benzamide
CID 24679174
4-[[[2-chloro-5-(trifluoromethyl)phenyl]sulfonyl-cyclopropylamino]methyl]-N-cyclopropylbenzamide
CID 24679147
4-[[benzenesulfonyl(methyl)amino]methyl]-N-cyclopropylbenzamide
CID 95933789
N-cyclopropyl-4-[[cyclopropyl-[2-(4-nitrophenyl)ethylsulfonyl]amino]methyl]benzamide
CID 75384695
4-[[cyclopropyl(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)amino]methyl]-N-methylbenzamide
CID 24679207
N-cyclopropyl-N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 33340647
N-cyclopropyl-4-[[cyclopropyl(propanoyl)amino]methyl]benzamide
CID 33341018
N-cyclopropyl-4-[[cyclopropyl-(4-methoxybenzoyl)amino]methyl]benzamide
CID 34178936
N-cyclopropyl-4-[[(3,4-dimethylphenyl)sulfonyl-(furan-2-ylmethyl)amino]methyl]benzamide
CID 24679289
N-[[4-(cyclopropylcarbamoyl)phenyl]methyl]-5-(diethylsulfamoyl)-N,2-dimethylbenzamide
CID 38394548
methyl 3-[cyclopropyl-[(4-methylphenyl)methyl]sulfamoyl]benzoate
CID 35403081

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide?
The IUPAC name of N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide (CID 24679131) is N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide.
What is the SMILES notation for N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide?
The canonical SMILES for N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide is O=C(NC1CC1)c1ccc(CN(C2CC2)S(=O)(=O)c2ccc3ccccc3c2)cc1.
What is the InChIKey of N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide?
The InChIKey is YIJYLYGSONUAQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24N2O3S/c27-24(25-21-10-11-21)19-7-5-17(6-8-19)16-26(22-12-13-22)30(28,29)23-14-9-18-3-1-2-4-20(18)15-23/h1-9,14-15,21-22H,10-13,16H2,(H,25,27).
What are the key properties of N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide?
N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide has a molecular weight of 420.53 g/mol, XLogP of 4.09, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-[[cyclopropyl(naphthalen-2-ylsulfonyl)amino]methyl]benzamide is sourced from PubChem (CID 24679131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).