N,N-dibenzylcyclohexanesulfonamide

C20H25NO2S — CID 162418871

IUPACN,N-dibenzylcyclohexanesulfonamide
SMILESO=S(=O)(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H25NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyXMNLBVRKNYIQHQ-UHFFFAOYSA-N
MW343.49 g/mol
LogP4.35
Rot. Bonds6

About N,N-dibenzylcyclohexanesulfonamide

N,N-dibenzylcyclohexanesulfonamide (PubChem CID 162418871) has the molecular formula C20H25NO2S and a molecular weight of 343.49 g/mol. Its IUPAC name is N,N-dibenzylcyclohexanesulfonamide.

Molecular Properties

Compound NameN,N-dibenzylcyclohexanesulfonamide
PubChem CID162418871
Molecular FormulaC20H25NO2S
Molecular Weight343.49 g/mol
Exact Mass343.16
IUPAC NameN,N-dibenzylcyclohexanesulfonamide
SMILESO=S(=O)(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1
InChIInChI=1S/C20H25NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2
InChIKeyXMNLBVRKNYIQHQ-UHFFFAOYSA-N
XLogP4.35
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.49
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-N-benzylcyclopentanesulfonamide
CID 107366552
2-[(4-aminophenyl)methyl-cyclopentylsulfonylamino]acetamide
CID 105360561
N-(2-aminoethyl)-N-benzyl-1-cyclohexylmethanesulfonamide;hydrochloride
CID 120584146
N-benzyl-N-ethyl-1,1-dioxothiolane-3-sulfonamide
CID 18593878
N-[(2-aminophenyl)methyl]-N-ethylcyclopentanesulfonamide
CID 105360552
N-[[3-(aminomethyl)phenyl]methyl]-N-methylcyclohexanesulfonamide
CID 61065125
benzyl(cyclohexylmethyl)carbamic acid
CID 57063774
N-(2-aminoethyl)-N-benzyl-1,1-dioxothiolane-3-sulfonamide
CID 106511503
N-benzyl-N-(cyclobutylmethyl)piperidine-1-sulfonamide
CID 86841877
benzyl(cyclohexylsulfamoyl)carbamic acid
CID 66859599
4-[[cyclopentylsulfonyl(methyl)amino]methyl]benzoic acid
CID 105360749
sodium N,N-dibenzylsulfamate
CID 141380855

Frequently Asked Questions

What is the IUPAC name of N,N-dibenzylcyclohexanesulfonamide?
The IUPAC name of N,N-dibenzylcyclohexanesulfonamide (CID 162418871) is N,N-dibenzylcyclohexanesulfonamide.
What is the SMILES notation for N,N-dibenzylcyclohexanesulfonamide?
The canonical SMILES for N,N-dibenzylcyclohexanesulfonamide is O=S(=O)(C1CCCCC1)N(Cc1ccccc1)Cc1ccccc1.
What is the InChIKey of N,N-dibenzylcyclohexanesulfonamide?
The InChIKey is XMNLBVRKNYIQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25NO2S/c22-24(23,20-14-8-3-9-15-20)21(16-18-10-4-1-5-11-18)17-19-12-6-2-7-13-19/h1-2,4-7,10-13,20H,3,8-9,14-17H2.
What are the key properties of N,N-dibenzylcyclohexanesulfonamide?
N,N-dibenzylcyclohexanesulfonamide has a molecular weight of 343.49 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dibenzylcyclohexanesulfonamide is sourced from PubChem (CID 162418871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).