1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane

C8H18N2O3S — CID 62521242

IUPAC1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane
SMILESCN(C)S(=O)(=O)NC1(CO)CCCC1
InChIInChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-8(7-11)5-3-4-6-8/h9,11H,3-7H2,1-2H3
InChIKeyKPDNJJUYUOFTLT-UHFFFAOYSA-N
MW222.31 g/mol
LogP-0.31
Rot. Bonds4

About 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane

1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane (PubChem CID 62521242) has the molecular formula C8H18N2O3S and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane
PubChem CID62521242
Molecular FormulaC8H18N2O3S
Molecular Weight222.31 g/mol
Exact Mass222.10
IUPAC Name1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane
SMILESCN(C)S(=O)(=O)NC1(CO)CCCC1
InChIInChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-8(7-11)5-3-4-6-8/h9,11H,3-7H2,1-2H3
InChIKeyKPDNJJUYUOFTLT-UHFFFAOYSA-N
XLogP-0.31
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
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)-1-(hydroxymethyl)cyclopentane?
The IUPAC name of 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane (CID 62521242) is 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane.
What is the SMILES notation for 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane?
The canonical SMILES for 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane is CN(C)S(=O)(=O)NC1(CO)CCCC1.
What is the InChIKey of 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane?
The InChIKey is KPDNJJUYUOFTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O3S/c1-10(2)14(12,13)9-8(7-11)5-3-4-6-8/h9,11H,3-7H2,1-2H3.
What are the key properties of 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane?
1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane has a molecular weight of 222.31 g/mol, XLogP of -0.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane is sourced from PubChem (CID 62521242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).