1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane

C15H30N2O3S — CID 65121626

IUPAC1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane
SMILESCC1CCC(O)(CNS(=O)(=O)N(C)C2CCCCC2)CC1
InChIInChI=1S/C15H30N2O3S/c1-13-8-10-15(18,11-9-13)12-16-21(19,20)17(2)14-6-4-3-5-7-14/h13-14,16,18H,3-12H2,1-2H3
InChIKeyHLWCYRKIIBTBBP-UHFFFAOYSA-N
MW318.48 g/mol
LogP2.03
Rot. Bonds5

About 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane

1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane (PubChem CID 65121626) has the molecular formula C15H30N2O3S and a molecular weight of 318.48 g/mol. Its IUPAC name is 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane.

Molecular Properties

Compound Name1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane
PubChem CID65121626
Molecular FormulaC15H30N2O3S
Molecular Weight318.48 g/mol
Exact Mass318.20
IUPAC Name1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane
SMILESCC1CCC(O)(CNS(=O)(=O)N(C)C2CCCCC2)CC1
InChIInChI=1S/C15H30N2O3S/c1-13-8-10-15(18,11-9-13)12-16-21(19,20)17(2)14-6-4-3-5-7-14/h13-14,16,18H,3-12H2,1-2H3
InChIKeyHLWCYRKIIBTBBP-UHFFFAOYSA-N
XLogP2.03
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.48
LogP ≤ 52.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-hydroxy-4-methyl-1-[(sulfamoylamino)methyl]cyclohexane
CID 112573807
1-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]methanesulfonamide
CID 65123212
1-[(cyclopropylsulfamoylamino)methyl]-4-methylcyclohexan-1-ol
CID 114809564
4-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]oxane-4-carboxamide
CID 56797555
N-[(1-hydroxy-4-methylcyclohexyl)methyl]butane-1-sulfonamide
CID 65121537
N-[2-[[cyclohexyl(methyl)sulfamoyl]amino]ethyl]acetamide
CID 47157246
[5-hydroxypentylsulfamoyl(methyl)amino]cyclohexane
CID 107319547
3-chloro-N-[(1-hydroxy-4-methylcyclohexyl)methyl]propane-1-sulfonamide
CID 65123213
[2-(ethylamino)ethylsulfamoyl-methylamino]cyclohexane
CID 55100441
[methyl-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]amino]cyclohexane
CID 103834038
1-[(cyclobutylamino)methyl]-4-methylcyclohexan-1-ol
CID 65115377
1-[(2-methoxyethylsulfamoylamino)methyl]-4-methylcyclohexan-1-ol
CID 114815694

Frequently Asked Questions

What is the IUPAC name of 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane?
The IUPAC name of 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane (CID 65121626) is 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane.
What is the SMILES notation for 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane?
The canonical SMILES for 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane is CC1CCC(O)(CNS(=O)(=O)N(C)C2CCCCC2)CC1.
What is the InChIKey of 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane?
The InChIKey is HLWCYRKIIBTBBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O3S/c1-13-8-10-15(18,11-9-13)12-16-21(19,20)17(2)14-6-4-3-5-7-14/h13-14,16,18H,3-12H2,1-2H3.
What are the key properties of 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane?
1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane has a molecular weight of 318.48 g/mol, XLogP of 2.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[[cyclohexyl(methyl)sulfamoyl]amino]methyl]-1-hydroxy-4-methylcyclohexane is sourced from PubChem (CID 65121626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).