methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate

C12H21NO4S — CID 103343145

IUPACmethyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCC1CC1
InChIInChI=1S/C12H21NO4S/c1-17-12(14)10-3-2-4-11(10)18(15,16)13-8-7-9-5-6-9/h9-11,13H,2-8H2,1H3
InChIKeyRHVVICMCQSKLSV-UHFFFAOYSA-N
MW275.37 g/mol
LogP1.05
Rot. Bonds6

About methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate

methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate (PubChem CID 103343145) has the molecular formula C12H21NO4S and a molecular weight of 275.37 g/mol. Its IUPAC name is methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate
PubChem CID103343145
Molecular FormulaC12H21NO4S
Molecular Weight275.37 g/mol
Exact Mass275.12
IUPAC Namemethyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCC1CC1
InChIInChI=1S/C12H21NO4S/c1-17-12(14)10-3-2-4-11(10)18(15,16)13-8-7-9-5-6-9/h9-11,13H,2-8H2,1H3
InChIKeyRHVVICMCQSKLSV-UHFFFAOYSA-N
XLogP1.05
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.37
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342396
trans-methyl (1R,2S)-2-(2-ethoxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 99794576
methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342813
methyl 2-[(4-ethoxy-4-oxobutyl)sulfamoyl]cyclopentane-1-carboxylate
CID 103343105
methyl 2-(2-morpholin-4-ylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342202
methyl 2-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]cyclopentane-1-carboxylate
CID 106543941
methyl 2-(propan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103342116
methyl 2-(2,2-diethoxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103343206
methyl 2-[(1,1-dioxothiolan-3-yl)methylsulfamoyl]cyclopentane-1-carboxylate
CID 103342714
methyl 2-(pyridin-4-ylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342294
methyl 2-(dicyclopropylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342807
methyl 2-[(3-methylphenyl)methylsulfamoyl]cyclopentane-1-carboxylate
CID 103342542

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate?
The IUPAC name of methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate (CID 103343145) is methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate.
What is the SMILES notation for methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate?
The canonical SMILES for methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate is COC(=O)C1CCCC1S(=O)(=O)NCCC1CC1.
What is the InChIKey of methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate?
The InChIKey is RHVVICMCQSKLSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO4S/c1-17-12(14)10-3-2-4-11(10)18(15,16)13-8-7-9-5-6-9/h9-11,13H,2-8H2,1H3.
What are the key properties of methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate?
methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate has a molecular weight of 275.37 g/mol, XLogP of 1.05, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 103343145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).