(dimethylsulfamoylamino)methylcyclohexane

C9H20N2O2S — CID 35292128

IUPAC(dimethylsulfamoylamino)methylcyclohexane
SMILESCN(C)S(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C9H20N2O2S/c1-11(2)14(12,13)10-8-9-6-4-3-5-7-9/h9-10H,3-8H2,1-2H3
InChIKeyJXTALGHSELKTFX-UHFFFAOYSA-N
MW220.34 g/mol
LogP0.96
Rot. Bonds4

About (dimethylsulfamoylamino)methylcyclohexane

(dimethylsulfamoylamino)methylcyclohexane (PubChem CID 35292128) has the molecular formula C9H20N2O2S and a molecular weight of 220.34 g/mol. Its IUPAC name is (dimethylsulfamoylamino)methylcyclohexane.

Molecular Properties

Compound Name(dimethylsulfamoylamino)methylcyclohexane
PubChem CID35292128
Molecular FormulaC9H20N2O2S
Molecular Weight220.34 g/mol
Exact Mass220.12
IUPAC Name(dimethylsulfamoylamino)methylcyclohexane
SMILESCN(C)S(=O)(=O)NCC1CCCCC1
InChIInChI=1S/C9H20N2O2S/c1-11(2)14(12,13)10-8-9-6-4-3-5-7-9/h9-10H,3-8H2,1-2H3
InChIKeyJXTALGHSELKTFX-UHFFFAOYSA-N
XLogP0.96
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (dimethylsulfamoylamino)methylcyclohexane?
The IUPAC name of (dimethylsulfamoylamino)methylcyclohexane (CID 35292128) is (dimethylsulfamoylamino)methylcyclohexane.
What is the SMILES notation for (dimethylsulfamoylamino)methylcyclohexane?
The canonical SMILES for (dimethylsulfamoylamino)methylcyclohexane is CN(C)S(=O)(=O)NCC1CCCCC1.
What is the InChIKey of (dimethylsulfamoylamino)methylcyclohexane?
The InChIKey is JXTALGHSELKTFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20N2O2S/c1-11(2)14(12,13)10-8-9-6-4-3-5-7-9/h9-10H,3-8H2,1-2H3.
What are the key properties of (dimethylsulfamoylamino)methylcyclohexane?
(dimethylsulfamoylamino)methylcyclohexane has a molecular weight of 220.34 g/mol, XLogP of 0.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (dimethylsulfamoylamino)methylcyclohexane is sourced from PubChem (CID 35292128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).