1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide

C14H28N2O2S — CID 114955890

IUPAC1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide
SMILESCC1CCNCC1CNS(=O)(=O)CC1CCCCC1
InChIInChI=1S/C14H28N2O2S/c1-12-7-8-15-9-14(12)10-16-19(17,18)11-13-5-3-2-4-6-13/h12-16H,2-11H2,1H3
InChIKeyQIFRASIHEADDHT-UHFFFAOYSA-N
MW288.46 g/mol
LogP1.73
Rot. Bonds5

About 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide

1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide (PubChem CID 114955890) has the molecular formula C14H28N2O2S and a molecular weight of 288.46 g/mol. Its IUPAC name is 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide.

Molecular Properties

Compound Name1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide
PubChem CID114955890
Molecular FormulaC14H28N2O2S
Molecular Weight288.46 g/mol
Exact Mass288.19
IUPAC Name1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide
SMILESCC1CCNCC1CNS(=O)(=O)CC1CCCCC1
InChIInChI=1S/C14H28N2O2S/c1-12-7-8-15-9-14(12)10-16-19(17,18)11-13-5-3-2-4-6-13/h12-16H,2-11H2,1H3
InChIKeyQIFRASIHEADDHT-UHFFFAOYSA-N
XLogP1.73
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-1-piperidin-3-ylmethanesulfonamide
CID 54972626
3-methoxy-N-[(4-methylpiperidin-3-yl)methyl]propane-1-sulfonamide
CID 114955853
2-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]acetamide
CID 114955699
N-[(2-aminocyclohexyl)methyl]-1-cyclohexylmethanesulfonamide
CID 64929835
1-cyclohexyl-N-[(3-ethylpiperidin-2-yl)methyl]methanesulfonamide
CID 82734539
N-[(4-methylpiperidin-3-yl)methyl]-2-phenylethanesulfonamide
CID 114955845
N-[[2-(bromomethyl)cyclohexyl]methyl]-1-cyclohexylmethanesulfonamide
CID 114295370
1-cyclohexyl-N-(pyrrolidin-2-ylmethyl)methanesulfonamide;hydrochloride
CID 119974331
1-cyclohexyl-N-[(6-methylpiperidin-2-yl)methyl]methanesulfonamide
CID 62321267
N-[(2-methylcyclohexyl)methyl]pyrrolidine-3-sulfonamide
CID 65422436
1-cyclopentyl-N-[[(2R)-pyrrolidin-2-yl]methyl]methanesulfonamide
CID 121497367
N-[(4-methylpiperidin-3-yl)methyl]-2,3-dihydro-1H-indene-5-sulfonamide
CID 114955865

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide?
The IUPAC name of 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide (CID 114955890) is 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide.
What is the SMILES notation for 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide?
The canonical SMILES for 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide is CC1CCNCC1CNS(=O)(=O)CC1CCCCC1.
What is the InChIKey of 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide?
The InChIKey is QIFRASIHEADDHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O2S/c1-12-7-8-15-9-14(12)10-16-19(17,18)11-13-5-3-2-4-6-13/h12-16H,2-11H2,1H3.
What are the key properties of 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide?
1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide has a molecular weight of 288.46 g/mol, XLogP of 1.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-N-[(4-methylpiperidin-3-yl)methyl]methanesulfonamide is sourced from PubChem (CID 114955890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).