3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane

C10H24N2O3S — CID 65113148

IUPAC3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane
SMILESCCC(O)(CC)CNS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C10H24N2O3S/c1-6-10(13,7-2)8-11-16(14,15)12(5)9(3)4/h9,11,13H,6-8H2,1-5H3
InChIKeyPNFYZGWRBUPOEF-UHFFFAOYSA-N
MW252.38 g/mol
LogP0.71
Rot. Bonds7

About 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane

3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane (PubChem CID 65113148) has the molecular formula C10H24N2O3S and a molecular weight of 252.38 g/mol. Its IUPAC name is 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane.

Molecular Properties

Compound Name3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane
PubChem CID65113148
Molecular FormulaC10H24N2O3S
Molecular Weight252.38 g/mol
Exact Mass252.15
IUPAC Name3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane
SMILESCCC(O)(CC)CNS(=O)(=O)N(C)C(C)C
InChIInChI=1S/C10H24N2O3S/c1-6-10(13,7-2)8-11-16(14,15)12(5)9(3)4/h9,11,13H,6-8H2,1-5H3
InChIKeyPNFYZGWRBUPOEF-UHFFFAOYSA-N
XLogP0.71
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane?
The IUPAC name of 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane (CID 65113148) is 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane.
What is the SMILES notation for 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane?
The canonical SMILES for 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane is CCC(O)(CC)CNS(=O)(=O)N(C)C(C)C.
What is the InChIKey of 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane?
The InChIKey is PNFYZGWRBUPOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3S/c1-6-10(13,7-2)8-11-16(14,15)12(5)9(3)4/h9,11,13H,6-8H2,1-5H3.
What are the key properties of 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane?
3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane has a molecular weight of 252.38 g/mol, XLogP of 0.71, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-3-[[[methyl(propan-2-yl)sulfamoyl]amino]methyl]pentane is sourced from PubChem (CID 65113148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).