1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid

C8H16N2O4S — CID 43163284

IUPAC1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid
SMILESCN(C)S(=O)(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C8H16N2O4S/c1-10(2)15(13,14)9-8(7(11)12)5-3-4-6-8/h9H,3-6H2,1-2H3,(H,11,12)
InChIKeyMROYWVRCUOTMLW-UHFFFAOYSA-N
MW236.29 g/mol
LogP-0.22
Rot. Bonds4

About 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid

1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid (PubChem CID 43163284) has the molecular formula C8H16N2O4S and a molecular weight of 236.29 g/mol. Its IUPAC name is 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid
PubChem CID43163284
Molecular FormulaC8H16N2O4S
Molecular Weight236.29 g/mol
Exact Mass236.08
IUPAC Name1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid
SMILESCN(C)S(=O)(=O)NC1(C(=O)O)CCCC1
InChIInChI=1S/C8H16N2O4S/c1-10(2)15(13,14)9-8(7(11)12)5-3-4-6-8/h9H,3-6H2,1-2H3,(H,11,12)
InChIKeyMROYWVRCUOTMLW-UHFFFAOYSA-N
XLogP-0.22
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.29
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 1-(dimethylsulfamoylamino)cycloheptane-1-carboxylate
CID 35326429
1-(dimethylsulfamoylamino)-1-(hydroxymethyl)cyclopentane
CID 62521242
2-[1-(dimethylsulfamoylamino)cyclohexyl]acetic acid
CID 64700173
1-(methylsulfonylmethylsulfonylamino)cyclopentane-1-carboxylic acid
CID 82839909
1-(trifluoromethylsulfonylamino)cycloheptane-1-carboxylic acid
CID 43361680
1-[(2-methoxy-2-oxoethyl)sulfonylamino]cyclopentane-1-carboxylic acid
CID 61358172
3-methyl-1-[[methyl(propan-2-yl)sulfamoyl]amino]cyclohexane-1-carboxylic acid
CID 61455545
1-(cyclohexylsulfonylamino)cycloheptane-1-carboxylic acid
CID 61066003
1-(cyclohexylsulfonylamino)cyclopentane-1-carboxylic acid
CID 61065837
1-[(4-methylpiperazin-1-yl)sulfonylamino]cyclohexane-1-carboxylic acid
CID 11573082
1-(2-methylsulfonylethylsulfonylamino)cyclobutane-1-carboxylic acid
CID 81163920
1-(ethylsulfonylamino)cyclopropane-1-carboxylic acid
CID 61355189

Frequently Asked Questions

What is the IUPAC name of 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid (CID 43163284) is 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid is CN(C)S(=O)(=O)NC1(C(=O)O)CCCC1.
What is the InChIKey of 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid?
The InChIKey is MROYWVRCUOTMLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O4S/c1-10(2)15(13,14)9-8(7(11)12)5-3-4-6-8/h9H,3-6H2,1-2H3,(H,11,12).
What are the key properties of 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid?
1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid has a molecular weight of 236.29 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(dimethylsulfamoylamino)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43163284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).