methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate

C14H26N2O4S — CID 103342813

IUPACmethyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCN1CCCCC1
InChIInChI=1S/C14H26N2O4S/c1-20-14(17)12-6-5-7-13(12)21(18,19)15-8-11-16-9-3-2-4-10-16/h12-13,15H,2-11H2,1H3
InChIKeyOPFDGHDWDMROFH-UHFFFAOYSA-N
MW318.44 g/mol
LogP0.73
Rot. Bonds6

About methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate

methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate (PubChem CID 103342813) has the molecular formula C14H26N2O4S and a molecular weight of 318.44 g/mol. Its IUPAC name is methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate
PubChem CID103342813
Molecular FormulaC14H26N2O4S
Molecular Weight318.44 g/mol
Exact Mass318.16
IUPAC Namemethyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCN1CCCCC1
InChIInChI=1S/C14H26N2O4S/c1-20-14(17)12-6-5-7-13(12)21(18,19)15-8-11-16-9-3-2-4-10-16/h12-13,15H,2-11H2,1H3
InChIKeyOPFDGHDWDMROFH-UHFFFAOYSA-N
XLogP0.73
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.44
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(2-morpholin-4-ylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342202
methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342396
methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103343145
trans-methyl (1R,2S)-2-(2-ethoxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 99794576
methyl 2-[(4-ethoxy-4-oxobutyl)sulfamoyl]cyclopentane-1-carboxylate
CID 103343105
methyl 2-(cyclooctylsulfamoyl)cyclopentane-1-carboxylate
CID 103342256
methyl 2-(propan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103342116
methyl 2-(2,2-diethoxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103343206
methyl 2-(dicyclopropylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342807
methyl 2-[(3,3,3-trifluoro-2-hydroxypropyl)sulfamoyl]cyclopentane-1-carboxylate
CID 106543941
methyl 2-[(1-aminocycloheptyl)methylsulfamoyl]cyclohexane-1-carboxylate
CID 120875669
methyl 2-[(1-methylimidazol-2-yl)methylsulfamoyl]cyclopentane-1-carboxylate
CID 103342994

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate?
The IUPAC name of methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate (CID 103342813) is methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate.
What is the SMILES notation for methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate?
The canonical SMILES for methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate is COC(=O)C1CCCC1S(=O)(=O)NCCN1CCCCC1.
What is the InChIKey of methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate?
The InChIKey is OPFDGHDWDMROFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O4S/c1-20-14(17)12-6-5-7-13(12)21(18,19)15-8-11-16-9-3-2-4-10-16/h12-13,15H,2-11H2,1H3.
What are the key properties of methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate?
methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate has a molecular weight of 318.44 g/mol, XLogP of 0.73, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-piperidin-1-ylethylsulfamoyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 103342813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).