N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide

C14H21NO2S — CID 669286

IUPACN-cyclohexyl-N-methyl-1-phenylmethanesulfonamide
SMILESCN(C1CCCCC1)S(=O)(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2S/c1-15(14-10-6-3-7-11-14)18(16,17)12-13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3
InChIKeyOEWLPZUQTCOEMF-UHFFFAOYSA-N
MW267.39 g/mol
LogP2.78
Rot. Bonds4

About N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide

N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide (PubChem CID 669286) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-N-methyl-1-phenylmethanesulfonamide
PubChem CID669286
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC NameN-cyclohexyl-N-methyl-1-phenylmethanesulfonamide
SMILESCN(C1CCCCC1)S(=O)(=O)Cc1ccccc1
InChIInChI=1S/C14H21NO2S/c1-15(14-10-6-3-7-11-14)18(16,17)12-13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3
InChIKeyOEWLPZUQTCOEMF-UHFFFAOYSA-N
XLogP2.78
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 52.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Phenylmethanesulfonyl-piperidine
CID 273955
N-(4-phenylbutyl)ethanesulfonamide
CID 2179616
N-(3-phenylpropyl)ethanesulfonamide
CID 2167095
1-(4-Methyl benzene)-sulfonyl-cis-2,6-dimethylpiperidine
CID 27764355
3-[1-(3-Phenylprop-2-yn-1-yl)piperidinium-1-yl]propane-1-sulfonate
CID 4642982
1-(Benzylsulfonyl)azepane
CID 669274
4-{Dimethyl[5-(4-phenylphenyl)pentyl]azaniumyl}butane-1-sulfonate
CID 10092584
1-Benzylsulfonyl-4-ethylpiperazine
CID 645383
4-Benzyl-1-(benzylsulfonyl)piperidine
CID 669284
1-(4-Methyl-cyclohexyl)-4-phenylmethanesulfonyl-piperazine
CID 1151775
4-Benzyl-1-(2-phenylethenesulfonyl)piperidine
CID 2475510
1-Ethylsulfonyl-4-(4-phenylbutan-2-yl)piperazine
CID 2902684

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide?
The IUPAC name of N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide (CID 669286) is N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide.
What is the SMILES notation for N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide?
The canonical SMILES for N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide is CN(C1CCCCC1)S(=O)(=O)Cc1ccccc1.
What is the InChIKey of N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide?
The InChIKey is OEWLPZUQTCOEMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c1-15(14-10-6-3-7-11-14)18(16,17)12-13-8-4-2-5-9-13/h2,4-5,8-9,14H,3,6-7,10-12H2,1H3.
What are the key properties of N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide?
N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide has a molecular weight of 267.39 g/mol, XLogP of 2.78, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-methyl-1-phenylmethanesulfonamide is sourced from PubChem (CID 669286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).