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

C9H17NO5S — CID 103342396

IUPACmethyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCO
InChIInChI=1S/C9H17NO5S/c1-15-9(12)7-3-2-4-8(7)16(13,14)10-5-6-11/h7-8,10-11H,2-6H2,1H3
InChIKeyHMVNUKHYNSOXKZ-UHFFFAOYSA-N
MW251.30 g/mol
LogP-0.76
Rot. Bonds5

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

methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate (PubChem CID 103342396) has the molecular formula C9H17NO5S and a molecular weight of 251.30 g/mol. Its IUPAC name is methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
PubChem CID103342396
Molecular FormulaC9H17NO5S
Molecular Weight251.30 g/mol
Exact Mass251.08
IUPAC Namemethyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NCCO
InChIInChI=1S/C9H17NO5S/c1-15-9(12)7-3-2-4-8(7)16(13,14)10-5-6-11/h7-8,10-11H,2-6H2,1H3
InChIKeyHMVNUKHYNSOXKZ-UHFFFAOYSA-N
XLogP-0.76
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.30
LogP ≤ 5-0.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(2-cyclopropylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103343145
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-[(2-ethyl-4-hydroxybutyl)sulfamoyl]cyclopentane-1-carboxylate
CID 103343233
methyl 2-(2-morpholin-4-ylethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342202
methyl 2-[(4-ethoxy-4-oxobutyl)sulfamoyl]cyclopentane-1-carboxylate
CID 103343105
methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103342399
methyl 2-(propan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103342116
methyl 2-(2,2-diethoxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103343206
methyl 2-[(1-hydroxy-4-methylpentan-3-yl)sulfamoyl]cyclopentane-1-carboxylate
CID 106543946
methyl 2-(pyridin-4-ylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342294
methyl 2-(dicyclopropylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342807

Frequently Asked Questions

What is the IUPAC name of methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate?
The IUPAC name of methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate (CID 103342396) is methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate.
What is the SMILES notation for methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate?
The canonical SMILES for methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate is COC(=O)C1CCCC1S(=O)(=O)NCCO.
What is the InChIKey of methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate?
The InChIKey is HMVNUKHYNSOXKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO5S/c1-15-9(12)7-3-2-4-8(7)16(13,14)10-5-6-11/h7-8,10-11H,2-6H2,1H3.
What are the key properties of methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate?
methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate has a molecular weight of 251.30 g/mol, XLogP of -0.76, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 103342396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).