1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide

C13H27NO3S — CID 79387330

IUPAC1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C13H27NO3S/c1-4-14(11-13(2,3)15)18(16,17)10-12-8-6-5-7-9-12/h12,15H,4-11H2,1-3H3
InChIKeySLUFTSNNAKQESC-UHFFFAOYSA-N
MW277.43 g/mol
LogP1.99
Rot. Bonds6

About 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide

1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide (PubChem CID 79387330) has the molecular formula C13H27NO3S and a molecular weight of 277.43 g/mol. Its IUPAC name is 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide
PubChem CID79387330
Molecular FormulaC13H27NO3S
Molecular Weight277.43 g/mol
Exact Mass277.17
IUPAC Name1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide
SMILESCCN(CC(C)(C)O)S(=O)(=O)CC1CCCCC1
InChIInChI=1S/C13H27NO3S/c1-4-14(11-13(2,3)15)18(16,17)10-12-8-6-5-7-9-12/h12,15H,4-11H2,1-3H3
InChIKeySLUFTSNNAKQESC-UHFFFAOYSA-N
XLogP1.99
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.43
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(Cyclohexylmethylsulfonyl)-3-methylpyrrolidin-3-ol
CID 103871356
1-cyclohexyl-N-(2-hydroxyethyl)-N-propan-2-ylmethanesulfonamide
CID 54947469
1-cyclohexyl-N,N-bis(2-hydroxyethyl)methanesulfonamide
CID 54947526
1-cyclohexyl-N-(2-hydroxyethyl)-N-propylmethanesulfonamide
CID 54947578
N-butyl-1-cyclohexyl-N-(2-hydroxyethyl)methanesulfonamide
CID 54947629
1-cyclohexyl-N-(2-hydroxyethyl)-N-pentan-3-ylmethanesulfonamide
CID 54998703
1-cyclohexyl-N-ethyl-N-(2-hydroxyethyl)methanesulfonamide
CID 61453825
1-cyclohexyl-N-(2-hydroxyethyl)-N-methylmethanesulfonamide
CID 61453826
1-cyclohexyl-N-(2-hydroxypropyl)-N-methylmethanesulfonamide
CID 62334090
1-[4-(Cyclohexylmethylsulfonyl)piperazin-1-yl]-2-methylpropan-2-ol
CID 64341908
1-cyclohexyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide
CID 64723973
1-(Cyclohexylmethylsulfonyl)-3-ethylazetidin-3-ol
CID 65929177

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide (CID 79387330) is 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide is CCN(CC(C)(C)O)S(=O)(=O)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide?
The InChIKey is SLUFTSNNAKQESC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO3S/c1-4-14(11-13(2,3)15)18(16,17)10-12-8-6-5-7-9-12/h12,15H,4-11H2,1-3H3.
What are the key properties of 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide?
1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide has a molecular weight of 277.43 g/mol, XLogP of 1.99, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-ethyl-N-(2-hydroxy-2-methylpropyl)methanesulfonamide is sourced from PubChem (CID 79387330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).