1-(dimethylsulfamoylamino)-4-hydroxycyclohexane

C8H18N2O3S — CID 43419371

IUPAC1-(dimethylsulfamoylamino)-4-hydroxycyclohexane
SMILESCN(C)S(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-7-3-5-8(11)6-4-7/h7-9,11H,3-6H2,1-2H3
InChIKeyYQTJERRAVDNCNJ-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.31
Rot. Bonds3

About 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane

1-(dimethylsulfamoylamino)-4-hydroxycyclohexane (PubChem CID 43419371) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-4-hydroxycyclohexane
PubChem CID43419371
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name1-(dimethylsulfamoylamino)-4-hydroxycyclohexane
SMILESCN(C)S(=O)(=O)NC1CCC(O)CC1
InChIInChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-7-3-5-8(11)6-4-7/h7-9,11H,3-6H2,1-2H3
InChIKeyYQTJERRAVDNCNJ-UHFFFAOYSA-N
XLogP-0.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane?
The IUPAC name of 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane (CID 43419371) is 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane?
The canonical SMILES for 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane is CN(C)S(=O)(=O)NC1CCC(O)CC1.
What is the InChIKey of 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane?
The InChIKey is YQTJERRAVDNCNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-7-3-5-8(11)6-4-7/h7-9,11H,3-6H2,1-2H3.
What are the key properties of 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane?
1-(dimethylsulfamoylamino)-4-hydroxycyclohexane has a molecular weight of 222.31 g/mol, XLogP of -0.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-4-hydroxycyclohexane is sourced from PubChem (CID 43419371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).