N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide

C17H22N4O4S — CID 97192198

IUPACN-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide
SMILESCc1nnc([C@@H](C)NS(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)o1
InChIInChI=1S/C17H22N4O4S/c1-11(17-20-19-12(2)25-17)21-26(23,24)15-9-5-6-13(10-15)16(22)18-14-7-3-4-8-14/h5-6,9-11,14,21H,3-4,7-8H2,1-2H3,(H,18,22)/t11-/m1/s1
InChIKeyBNQIZZASEVACCZ-LLVKDONJSA-N
MW378.45 g/mol
LogP2.09
Rot. Bonds6

About N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide

N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide (PubChem CID 97192198) has the molecular formula C17H22N4O4S and a molecular weight of 378.45 g/mol. Its IUPAC name is N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide
PubChem CID97192198
Molecular FormulaC17H22N4O4S
Molecular Weight378.45 g/mol
Exact Mass378.14
IUPAC NameN-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide
SMILESCc1nnc([C@@H](C)NS(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)o1
InChIInChI=1S/C17H22N4O4S/c1-11(17-20-19-12(2)25-17)21-26(23,24)15-9-5-6-13(10-15)16(22)18-14-7-3-4-8-14/h5-6,9-11,14,21H,3-4,7-8H2,1-2H3,(H,18,22)/t11-/m1/s1
InChIKeyBNQIZZASEVACCZ-LLVKDONJSA-N
XLogP2.09
TPSA114.19 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

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CID 55858222
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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide?
The IUPAC name of N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide (CID 97192198) is N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide.
What is the SMILES notation for N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide?
The canonical SMILES for N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide is Cc1nnc([C@@H](C)NS(=O)(=O)c2cccc(C(=O)NC3CCCC3)c2)o1.
What is the InChIKey of N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide?
The InChIKey is BNQIZZASEVACCZ-LLVKDONJSA-N. The full InChI is InChI=1S/C17H22N4O4S/c1-11(17-20-19-12(2)25-17)21-26(23,24)15-9-5-6-13(10-15)16(22)18-14-7-3-4-8-14/h5-6,9-11,14,21H,3-4,7-8H2,1-2H3,(H,18,22)/t11-/m1/s1.
What are the key properties of N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide?
N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide has a molecular weight of 378.45 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[[(1R)-1-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]sulfamoyl]benzamide is sourced from PubChem (CID 97192198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).