N,N-dicyclohexyl-2-methylpropane-2-sulfonamide

C16H31NO2S — CID 10542350

IUPACN,N-dicyclohexyl-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C16H31NO2S/c1-16(2,3)20(18,19)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3
InChIKeyWTUBMXIZZXBDBP-UHFFFAOYSA-N
MW301.50 g/mol
LogP4.08
Rot. Bonds3

About N,N-dicyclohexyl-2-methylpropane-2-sulfonamide

N,N-dicyclohexyl-2-methylpropane-2-sulfonamide (PubChem CID 10542350) has the molecular formula C16H31NO2S and a molecular weight of 301.50 g/mol. Its IUPAC name is N,N-dicyclohexyl-2-methylpropane-2-sulfonamide.

Molecular Properties

Compound NameN,N-dicyclohexyl-2-methylpropane-2-sulfonamide
PubChem CID10542350
Molecular FormulaC16H31NO2S
Molecular Weight301.50 g/mol
Exact Mass301.21
IUPAC NameN,N-dicyclohexyl-2-methylpropane-2-sulfonamide
SMILESCC(C)(C)S(=O)(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C16H31NO2S/c1-16(2,3)20(18,19)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3
InChIKeyWTUBMXIZZXBDBP-UHFFFAOYSA-N
XLogP4.08
TPSA37.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.50
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dicyclohexyl-1,1-difluoroethanesulfonamide
CID 58436010
N,N-dicyclohexyl-1,1,2,2,3,3-hexafluorobutane-1-sulfonamide
CID 88916706
N,N-dicyclohexyl-2-methylpropane-2-sulfinamide
CID 10565092
N,N-dicyclohexylmethanesulfonamide
CID 3475883
N,N-dicyclohexylethanesulfonamide
CID 3554785
N,N-dicyclohexyldodecane-1-sulfonamide
CID 15510196
N,N-dicyclohexylbutane-1-sulfonamide
CID 19682437
N-cyclohexyl-N-ethyl-3-methylbutane-1-sulfonamide
CID 58689101
N-cyclohexyl-3-methyl-N-propan-2-ylbutane-1-sulfonamide
CID 58689269
N,N-dicyclohexylpropane-2-sulfonamide
CID 64586724
N-cyclohexyl-2-methyl-N-pentan-2-ylpropane-2-sulfonamide
CID 70989634
N-cyclohexyl-N-pentan-2-ylethanesulfonamide
CID 70990681

Frequently Asked Questions

What is the IUPAC name of N,N-dicyclohexyl-2-methylpropane-2-sulfonamide?
The IUPAC name of N,N-dicyclohexyl-2-methylpropane-2-sulfonamide (CID 10542350) is N,N-dicyclohexyl-2-methylpropane-2-sulfonamide.
What is the SMILES notation for N,N-dicyclohexyl-2-methylpropane-2-sulfonamide?
The canonical SMILES for N,N-dicyclohexyl-2-methylpropane-2-sulfonamide is CC(C)(C)S(=O)(=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of N,N-dicyclohexyl-2-methylpropane-2-sulfonamide?
The InChIKey is WTUBMXIZZXBDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2S/c1-16(2,3)20(18,19)17(14-10-6-4-7-11-14)15-12-8-5-9-13-15/h14-15H,4-13H2,1-3H3.
What are the key properties of N,N-dicyclohexyl-2-methylpropane-2-sulfonamide?
N,N-dicyclohexyl-2-methylpropane-2-sulfonamide has a molecular weight of 301.50 g/mol, XLogP of 4.08, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dicyclohexyl-2-methylpropane-2-sulfonamide is sourced from PubChem (CID 10542350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).