methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate

C10H19NO5S — CID 103342399

IUPACmethyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NC(C)CO
InChIInChI=1S/C10H19NO5S/c1-7(6-12)11-17(14,15)9-5-3-4-8(9)10(13)16-2/h7-9,11-12H,3-6H2,1-2H3
InChIKeyZMSFAXMJQKOLOE-UHFFFAOYSA-N
MW265.33 g/mol
LogP-0.37
Rot. Bonds5

About methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate

methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate (PubChem CID 103342399) has the molecular formula C10H19NO5S and a molecular weight of 265.33 g/mol. Its IUPAC name is methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate.

Molecular Properties

Compound Namemethyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate
PubChem CID103342399
Molecular FormulaC10H19NO5S
Molecular Weight265.33 g/mol
Exact Mass265.10
IUPAC Namemethyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate
SMILESCOC(=O)C1CCCC1S(=O)(=O)NC(C)CO
InChIInChI=1S/C10H19NO5S/c1-7(6-12)11-17(14,15)9-5-3-4-8(9)10(13)16-2/h7-9,11-12H,3-6H2,1-2H3
InChIKeyZMSFAXMJQKOLOE-UHFFFAOYSA-N
XLogP-0.37
TPSA92.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.33
LogP ≤ 5-0.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

methyl 2-(propan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103342116
methyl 2-(dicyclopropylmethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342807
methyl 2-[(1-hydroxy-4-methylpentan-3-yl)sulfamoyl]cyclopentane-1-carboxylate
CID 106543946
methyl 2-(4-ethylsulfanylbutan-2-ylsulfamoyl)cyclopentane-1-carboxylate
CID 103343483
methyl 2-(2-hydroxyethylsulfamoyl)cyclopentane-1-carboxylate
CID 103342396
(2S)-2-[(2-methoxycarbonylcyclopentyl)sulfonylamino]-3-phenylpropanoic acid
CID 122069343
methyl 2-[4-(1-hydroxyethyl)piperidin-1-yl]sulfonylcyclopentane-1-carboxylate
CID 106835677
methyl 2-[[(1R)-1-thiophen-2-ylethyl]sulfamoyl]cyclopentane-1-carboxylate
CID 103343265
methyl 2-[(2-ethyl-4-hydroxybutyl)sulfamoyl]cyclopentane-1-carboxylate
CID 103343233
methyl 2-(cyclooctylsulfamoyl)cyclopentane-1-carboxylate
CID 103342256
methyl 2-chlorosulfonylcyclopentane-1-carboxylate
CID 83853182
trans-methyl (1R,2S)-2-chlorosulfonylcyclopentane-1-carboxylate
CID 98115809

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate?
The IUPAC name of methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate (CID 103342399) is methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate.
What is the SMILES notation for methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate?
The canonical SMILES for methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate is COC(=O)C1CCCC1S(=O)(=O)NC(C)CO.
What is the InChIKey of methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate?
The InChIKey is ZMSFAXMJQKOLOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO5S/c1-7(6-12)11-17(14,15)9-5-3-4-8(9)10(13)16-2/h7-9,11-12H,3-6H2,1-2H3.
What are the key properties of methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate?
methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate has a molecular weight of 265.33 g/mol, XLogP of -0.37, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1-hydroxypropan-2-ylsulfamoyl)cyclopentane-1-carboxylate is sourced from PubChem (CID 103342399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).