N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide

C17H24N2O4S — CID 97154955

IUPACN-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
SMILESO=C(NC1CCCCC1)c1ccc(S(=O)(=O)N[C@H]2CCOC2)cc1
InChIInChI=1S/C17H24N2O4S/c20-17(18-14-4-2-1-3-5-14)13-6-8-16(9-7-13)24(21,22)19-15-10-11-23-12-15/h6-9,14-15,19H,1-5,10-12H2,(H,18,20)/t15-/m0/s1
InChIKeyJPYJJJKQZULTLM-HNNXBMFYSA-N
MW352.46 g/mol
LogP1.82
Rot. Bonds5

About N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide

N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide (PubChem CID 97154955) has the molecular formula C17H24N2O4S and a molecular weight of 352.46 g/mol. Its IUPAC name is N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide.

Molecular Properties

Compound NameN-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
PubChem CID97154955
Molecular FormulaC17H24N2O4S
Molecular Weight352.46 g/mol
Exact Mass352.15
IUPAC NameN-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide
SMILESO=C(NC1CCCCC1)c1ccc(S(=O)(=O)N[C@H]2CCOC2)cc1
InChIInChI=1S/C17H24N2O4S/c20-17(18-14-4-2-1-3-5-14)13-6-8-16(9-7-13)24(21,22)19-15-10-11-23-12-15/h6-9,14-15,19H,1-5,10-12H2,(H,18,20)/t15-/m0/s1
InChIKeyJPYJJJKQZULTLM-HNNXBMFYSA-N
XLogP1.82
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.46
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(oxan-4-ylsulfamoyl)-N-(oxolan-3-yl)benzamide
CID 70734205
4-acetyl-N-(oxolan-3-yl)benzenesulfonamide
CID 80712927
N-cyclopentyl-4-[(1,1-dioxothiolan-3-yl)sulfamoyl]benzamide
CID 109059272
4-(oxan-3-ylsulfamoyl)benzenecarbothioamide
CID 63361664
4-morpholin-4-ylsulfonyl-N-(oxolan-3-yl)benzamide
CID 110868803
2-[4-(oxolan-3-ylsulfamoyl)phenoxy]acetic acid
CID 80717459
4-hydroxy-N-(oxolan-3-yl)benzamide
CID 80713158
4-(tert-butylsulfamoyl)-N-cyclopentylbenzamide
CID 18106170
3-(oxolan-3-ylsulfamoyl)benzoic acid
CID 80717368
N-cyclopentyl-4-(3-methylmorpholin-4-yl)sulfonylbenzamide
CID 110343683
4-[[(3S)-oxolan-3-yl]sulfamoyl]-N-(pyridin-3-ylmethyl)benzamide
CID 97115789
4-(benzenesulfonamido)-N-cyclooctylbenzamide
CID 24635133

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide?
The IUPAC name of N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide (CID 97154955) is N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide.
What is the SMILES notation for N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide?
The canonical SMILES for N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide is O=C(NC1CCCCC1)c1ccc(S(=O)(=O)N[C@H]2CCOC2)cc1.
What is the InChIKey of N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide?
The InChIKey is JPYJJJKQZULTLM-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H24N2O4S/c20-17(18-14-4-2-1-3-5-14)13-6-8-16(9-7-13)24(21,22)19-15-10-11-23-12-15/h6-9,14-15,19H,1-5,10-12H2,(H,18,20)/t15-/m0/s1.
What are the key properties of N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide?
N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide has a molecular weight of 352.46 g/mol, XLogP of 1.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-[[(3S)-oxolan-3-yl]sulfamoyl]benzamide is sourced from PubChem (CID 97154955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).