3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol

C11H26N2O3S — CID 106288332

IUPAC3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
SMILESCCC(CC)C(O)CNS(=O)(=O)NCC(C)C
InChIInChI=1S/C11H26N2O3S/c1-5-10(6-2)11(14)8-13-17(15,16)12-7-9(3)4/h9-14H,5-8H2,1-4H3
InChIKeyLTOKYUCQXXYDNJ-UHFFFAOYSA-N
MW266.41 g/mol
LogP0.86
Rot. Bonds9

About 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol

3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol (PubChem CID 106288332) has the molecular formula C11H26N2O3S and a molecular weight of 266.41 g/mol. Its IUPAC name is 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol.

Molecular Properties

Compound Name3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
PubChem CID106288332
Molecular FormulaC11H26N2O3S
Molecular Weight266.41 g/mol
Exact Mass266.17
IUPAC Name3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
SMILESCCC(CC)C(O)CNS(=O)(=O)NCC(C)C
InChIInChI=1S/C11H26N2O3S/c1-5-10(6-2)11(14)8-13-17(15,16)12-7-9(3)4/h9-14H,5-8H2,1-4H3
InChIKeyLTOKYUCQXXYDNJ-UHFFFAOYSA-N
XLogP0.86
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 50.86
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethyl-1-(propylsulfamoylamino)pentan-2-ol
CID 106288196
N-(3-ethyl-2-hydroxypentyl)-3-methylbutane-1-sulfonamide
CID 113317358
propan-2-yl N-[(3-ethyl-2-hydroxypentyl)sulfamoyl]carbamate
CID 106288291
N-(2-methylpropylsulfamoyl)butan-2-amine
CID 114814896
3-chloro-N-(3-ethyl-2-hydroxypentyl)-2-methylpropane-1-sulfonamide
CID 106288577
2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol
CID 114815684
N-(3-ethyl-2-hydroxypentyl)-2,4,6-trimethylbenzenesulfonamide
CID 103835154
4-amino-N-(3-ethyl-2-hydroxypentyl)-2,6-dimethylbenzenesulfonamide
CID 106284209
N-(tert-butylsulfamoyl)-2-methylpropan-1-amine
CID 104538392
3-(2-methylpropylsulfamoylamino)propan-1-ol
CID 114815587
N-(ethoxysulfamoyl)-2-methylpropan-1-amine
CID 114814909
4-bromo-2,6-dichloro-N-(3-ethyl-2-hydroxypentyl)benzenesulfonamide
CID 106288270

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol?
The IUPAC name of 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol (CID 106288332) is 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol.
What is the SMILES notation for 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol?
The canonical SMILES for 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol is CCC(CC)C(O)CNS(=O)(=O)NCC(C)C.
What is the InChIKey of 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol?
The InChIKey is LTOKYUCQXXYDNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3S/c1-5-10(6-2)11(14)8-13-17(15,16)12-7-9(3)4/h9-14H,5-8H2,1-4H3.
What are the key properties of 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol?
3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol has a molecular weight of 266.41 g/mol, XLogP of 0.86, 9 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol is sourced from PubChem (CID 106288332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).