1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide

C16H25NO3S — CID 111440041

IUPAC1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide
SMILESCc1ccccc1C(O)CNS(=O)(=O)CC1CCCCC1
InChIInChI=1S/C16H25NO3S/c1-13-7-5-6-10-15(13)16(18)11-17-21(19,20)12-14-8-3-2-4-9-14/h5-7,10,14,16-18H,2-4,8-9,11-12H2,1H3
InChIKeySWAORNGSAGFKMS-UHFFFAOYSA-N
MW311.45 g/mol
LogP2.53
Rot. Bonds6

About 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide

1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide (PubChem CID 111440041) has the molecular formula C16H25NO3S and a molecular weight of 311.45 g/mol. Its IUPAC name is 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide
PubChem CID111440041
Molecular FormulaC16H25NO3S
Molecular Weight311.45 g/mol
Exact Mass311.16
IUPAC Name1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide
SMILESCc1ccccc1C(O)CNS(=O)(=O)CC1CCCCC1
InChIInChI=1S/C16H25NO3S/c1-13-7-5-6-10-15(13)16(18)11-17-21(19,20)12-14-8-3-2-4-9-14/h5-7,10,14,16-18H,2-4,8-9,11-12H2,1H3
InChIKeySWAORNGSAGFKMS-UHFFFAOYSA-N
XLogP2.53
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.45
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-N-(2-methylpropyl)methanesulfonamide
CID 62735180
2-cyclohexyloxy-N-[2-hydroxy-2-(2-methylphenyl)ethyl]acetamide
CID 111120177
N-[3-[[2-hydroxy-2-(2-methylphenyl)ethyl]amino]-3-oxopropyl]cyclohexanecarboxamide
CID 111120078
2-(methylamino)-1-(2-methylphenyl)ethanol
CID 14888492
1-cyclohexyl-N-(2,2-dimethoxyethyl)methanesulfonamide
CID 62967339
[3-cyclohexyl-1-(2-methylphenyl)propyl]hydrazine
CID 105286051
(R)-cyclopentyl-(2-methylphenyl)methanol
CID 93312335
2-(cyclohexylmethylsulfonylamino)-3-methylbenzoic acid
CID 61453613
1-cyclohexyl-N-(2,2-diethoxyethyl)methanesulfonamide
CID 79547818
3-(cyclohexylmethylsulfonylamino)-2-methoxypropanoic acid
CID 104936692
2-[(3,3-dimethylcyclobutyl)methylamino]-1-(2-methylphenyl)ethanol
CID 123256673
1-cyclopentyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]pyrrole-2-carboxamide
CID 110007652

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide (CID 111440041) is 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide is Cc1ccccc1C(O)CNS(=O)(=O)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide?
The InChIKey is SWAORNGSAGFKMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3S/c1-13-7-5-6-10-15(13)16(18)11-17-21(19,20)12-14-8-3-2-4-9-14/h5-7,10,14,16-18H,2-4,8-9,11-12H2,1H3.
What are the key properties of 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide?
1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide has a molecular weight of 311.45 g/mol, XLogP of 2.53, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[2-hydroxy-2-(2-methylphenyl)ethyl]methanesulfonamide is sourced from PubChem (CID 111440041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).