propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate

C11H24N2O5S — CID 106288291

IUPACpropan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate
SMILESCCC(CC)C(O)CNS(=O)(=O)NC(=O)OC(C)C
InChIInChI=1S/C11H24N2O5S/c1-5-9(6-2)10(14)7-12-19(16,17)13-11(15)18-8(3)4/h8-10,12,14H,5-7H2,1-4H3,(H,13,15)
InChIKeyNOKIIRHVLRQCEE-UHFFFAOYSA-N
MW296.39 g/mol
LogP0.75
Rot. Bonds8

About propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate

propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate (PubChem CID 106288291) has the molecular formula C11H24N2O5S and a molecular weight of 296.39 g/mol. Its IUPAC name is propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate.

Molecular Properties

Compound Namepropan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate
PubChem CID106288291
Molecular FormulaC11H24N2O5S
Molecular Weight296.39 g/mol
Exact Mass296.14
IUPAC Namepropan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate
SMILESCCC(CC)C(O)CNS(=O)(=O)NC(=O)OC(C)C
InChIInChI=1S/C11H24N2O5S/c1-5-9(6-2)10(14)7-12-19(16,17)13-11(15)18-8(3)4/h8-10,12,14H,5-7H2,1-4H3,(H,13,15)
InChIKeyNOKIIRHVLRQCEE-UHFFFAOYSA-N
XLogP0.75
TPSA104.73 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.39
LogP ≤ 50.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(propan-2-yloxycarbonylsulfamoylamino)methyl]butanoic acid
CID 114462771
(2S)-2-hydroxy-3-(propan-2-yloxycarbonylsulfamoylamino)propanoic acid
CID 107835199
propan-2-yl N-[2-(methylamino)propylsulfamoyl]carbamate
CID 103512534
3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
CID 106288332
propan-2-yl N-[(2-chloro-3-methylbutyl)sulfamoyl]carbamate
CID 114466894
propan-2-yl N-[(3-amino-2-methylpropyl)sulfamoyl]carbamate
CID 114461386
propan-2-yl N-(butan-2-ylsulfamoyl)carbamate
CID 114463084
propan-2-yl N-[[2-(4-aminophenyl)-2-hydroxyethyl]sulfamoyl]carbamate
CID 114461589
propan-2-yl N-(ethoxysulfamoyl)carbamate
CID 114463121
3-ethyl-1-(propylsulfamoylamino)pentan-2-ol
CID 106288196
propan-2-yl N-(2-chlorosulfonylethylsulfamoyl)carbamate
CID 114467593
methyl N-[(2-chloro-3-ethylpentyl)sulfamoyl]carbamate
CID 106288784

Frequently Asked Questions

What is the IUPAC name of propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate?
The IUPAC name of propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate (CID 106288291) is propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate.
What is the SMILES notation for propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate?
The canonical SMILES for propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate is CCC(CC)C(O)CNS(=O)(=O)NC(=O)OC(C)C.
What is the InChIKey of propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate?
The InChIKey is NOKIIRHVLRQCEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O5S/c1-5-9(6-2)10(14)7-12-19(16,17)13-11(15)18-8(3)4/h8-10,12,14H,5-7H2,1-4H3,(H,13,15).
What are the key properties of propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate?
propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate has a molecular weight of 296.39 g/mol, XLogP of 0.75, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate is sourced from PubChem (CID 106288291), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).