2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol

C8H20N2O3S — CID 114815684

IUPAC2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol
SMILESCC(C)CNS(=O)(=O)NCC(C)CO
InChIInChI=1S/C8H20N2O3S/c1-7(2)4-9-14(12,13)10-5-8(3)6-11/h7-11H,4-6H2,1-3H3
InChIKeyATLJOJGWRXLYIR-UHFFFAOYSA-N
MW224.33 g/mol
LogP-0.31
Rot. Bonds7

About 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol

2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol (PubChem CID 114815684) has the molecular formula C8H20N2O3S and a molecular weight of 224.33 g/mol. Its IUPAC name is 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol
PubChem CID114815684
Molecular FormulaC8H20N2O3S
Molecular Weight224.33 g/mol
Exact Mass224.12
IUPAC Name2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol
SMILESCC(C)CNS(=O)(=O)NCC(C)CO
InChIInChI=1S/C8H20N2O3S/c1-7(2)4-9-14(12,13)10-5-8(3)6-11/h7-11H,4-6H2,1-3H3
InChIKeyATLJOJGWRXLYIR-UHFFFAOYSA-N
XLogP-0.31
TPSA78.43 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.33
LogP ≤ 5-0.31
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol 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

1-hydroxy-2-methyl-3-(sulfamoylamino)propane
CID 112689052
3-(2-methylpropylsulfamoylamino)propan-1-ol
CID 114815587
3-ethyl-1-(2-methylpropylsulfamoylamino)pentan-2-ol
CID 106288332
3-methoxy-2-(2-methylpropylsulfamoylamino)propan-1-ol
CID 106184934
[4-[(2-methylpropylsulfamoylamino)methyl]phenyl]methanol
CID 107232078
3-hydroxy-2,2-dimethyl-N-(2-methylpropyl)propane-1-sulfonamide
CID 94684465
N-(tert-butylsulfamoyl)-2-methylpropan-1-amine
CID 104538392
N-(2-methylpropylsulfamoyl)butan-2-amine
CID 114814896
2-hydroxy-2-methyl-3-(2-methylpropylsulfamoylamino)propanoic acid
CID 114814696
N-(3-hydroxy-2-methylpropyl)-4-(2-methylpropyl)benzenesulfonamide
CID 65033964
N-(ethoxysulfamoyl)-2-methylpropan-1-amine
CID 114814909
4-[(2-methylpropylsulfamoylamino)methyl]cyclohexan-1-ol
CID 114147014

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol?
The IUPAC name of 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol (CID 114815684) is 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol.
What is the SMILES notation for 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol?
The canonical SMILES for 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol is CC(C)CNS(=O)(=O)NCC(C)CO.
What is the InChIKey of 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol?
The InChIKey is ATLJOJGWRXLYIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O3S/c1-7(2)4-9-14(12,13)10-5-8(3)6-11/h7-11H,4-6H2,1-3H3.
What are the key properties of 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol?
2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol has a molecular weight of 224.33 g/mol, XLogP of -0.31, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2-methylpropylsulfamoylamino)propan-1-ol is sourced from PubChem (CID 114815684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).