propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate

C10H20N2O5S — CID 114464241

IUPACpropan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate
SMILESCC(C)OC(=O)NS(=O)(=O)NCC1(O)CCCC1
InChIInChI=1S/C10H20N2O5S/c1-8(2)17-9(13)12-18(15,16)11-7-10(14)5-3-4-6-10/h8,11,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyGUYGSXYWGUVWEV-UHFFFAOYSA-N
MW280.35 g/mol
LogP0.26
Rot. Bonds5

About propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate

propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate (PubChem CID 114464241) has the molecular formula C10H20N2O5S and a molecular weight of 280.35 g/mol. Its IUPAC name is propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate.

Molecular Properties

Compound Namepropan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate
PubChem CID114464241
Molecular FormulaC10H20N2O5S
Molecular Weight280.35 g/mol
Exact Mass280.11
IUPAC Namepropan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate
SMILESCC(C)OC(=O)NS(=O)(=O)NCC1(O)CCCC1
InChIInChI=1S/C10H20N2O5S/c1-8(2)17-9(13)12-18(15,16)11-7-10(14)5-3-4-6-10/h8,11,14H,3-7H2,1-2H3,(H,12,13)
InChIKeyGUYGSXYWGUVWEV-UHFFFAOYSA-N
XLogP0.26
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.35
LogP ≤ 50.26
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate?
The IUPAC name of propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate (CID 114464241) is propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate.
What is the SMILES notation for propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate?
The canonical SMILES for propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate is CC(C)OC(=O)NS(=O)(=O)NCC1(O)CCCC1.
What is the InChIKey of propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate?
The InChIKey is GUYGSXYWGUVWEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O5S/c1-8(2)17-9(13)12-18(15,16)11-7-10(14)5-3-4-6-10/h8,11,14H,3-7H2,1-2H3,(H,12,13).
What are the key properties of propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate?
propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate has a molecular weight of 280.35 g/mol, XLogP of 0.26, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-[(1-hydroxycyclopentyl)methylsulfamoyl]carbamate is sourced from PubChem (CID 114464241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).