N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide

C12H24N2O3S — CID 47108533

IUPACN-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C12H24N2O3S/c1-18(15,16)13-11-12(5-3-2-4-6-12)14-7-9-17-10-8-14/h13H,2-11H2,1H3
InChIKeyQRTHTIYPBJTXMD-UHFFFAOYSA-N
MW276.40 g/mol
LogP0.57
Rot. Bonds4

About N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide

N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide (PubChem CID 47108533) has the molecular formula C12H24N2O3S and a molecular weight of 276.40 g/mol. Its IUPAC name is N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide.

Molecular Properties

Compound NameN-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide
PubChem CID47108533
Molecular FormulaC12H24N2O3S
Molecular Weight276.40 g/mol
Exact Mass276.15
IUPAC NameN-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide
SMILESCS(=O)(=O)NCC1(N2CCOCC2)CCCCC1
InChIInChI=1S/C12H24N2O3S/c1-18(15,16)13-11-12(5-3-2-4-6-12)14-7-9-17-10-8-14/h13H,2-11H2,1H3
InChIKeyQRTHTIYPBJTXMD-UHFFFAOYSA-N
XLogP0.57
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(methylsulfonyl)-N-[(1-morpholin-4-ylcyclohexyl)methyl]piperidin-4-amine
CID 50974135
N-[(1-morpholin-4-ylcyclohexyl)methyl]piperidine-1-sulfonamide
CID 30667251
N-[(1-morpholin-4-ylcyclohexyl)methyl]propane-1-sulfonamide
CID 78793817
3-fluoro-N-[(1-morpholin-4-ylcyclohexyl)methyl]propane-1-sulfonamide
CID 72112328
4-[1-[(Dimethylsulfamoylamino)methyl]cyclohexyl]morpholine
CID 35304112
N-[[1-(4-methylpiperazin-1-yl)cyclohexyl]methyl]methanesulfonamide
CID 59088747
N-[1-(aminomethyl)cyclohexyl]morpholine-4-sulfonamide
CID 28940476
N-[(1-morpholin-4-ylcyclohexyl)methyl]azepane-1-sulfonamide
CID 30135931
N-[(1-morpholin-4-ylcyclohexyl)methyl]butane-1-sulfonamide
CID 35764241
N-[(1-aminocyclohexyl)methyl]morpholine-4-sulfonamide
CID 43598179
N-[(1-aminocyclohexyl)methyl]-2,6-dimethylmorpholine-4-sulfonamide
CID 43598200
N-(2-methyl-2-morpholin-4-ylbutyl)methanesulfonamide
CID 51079512

Frequently Asked Questions

What is the IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide?
The IUPAC name of N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide (CID 47108533) is N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide.
What is the SMILES notation for N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide?
The canonical SMILES for N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide is CS(=O)(=O)NCC1(N2CCOCC2)CCCCC1.
What is the InChIKey of N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide?
The InChIKey is QRTHTIYPBJTXMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O3S/c1-18(15,16)13-11-12(5-3-2-4-6-12)14-7-9-17-10-8-14/h13H,2-11H2,1H3.
What are the key properties of N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide?
N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide has a molecular weight of 276.40 g/mol, XLogP of 0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-morpholin-4-ylcyclohexyl)methyl]methanesulfonamide is sourced from PubChem (CID 47108533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).