3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane

C10H24N2O3S — CID 65113460

IUPAC3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane
SMILESCCN(CC)S(=O)(=O)NCC(O)(CC)CC
InChIInChI=1S/C10H24N2O3S/c1-5-10(13,6-2)9-11-16(14,15)12(7-3)8-4/h11,13H,5-9H2,1-4H3
InChIKeyDAGVNAXTGMDINJ-UHFFFAOYSA-N
MW252.38 g/mol
LogP0.71
Rot. Bonds8

About 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane

3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane (PubChem CID 65113460) has the molecular formula C10H24N2O3S and a molecular weight of 252.38 g/mol. Its IUPAC name is 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane.

Molecular Properties

Compound Name3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane
PubChem CID65113460
Molecular FormulaC10H24N2O3S
Molecular Weight252.38 g/mol
Exact Mass252.15
IUPAC Name3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane
SMILESCCN(CC)S(=O)(=O)NCC(O)(CC)CC
InChIInChI=1S/C10H24N2O3S/c1-5-10(13,6-2)9-11-16(14,15)12(7-3)8-4/h11,13H,5-9H2,1-4H3
InChIKeyDAGVNAXTGMDINJ-UHFFFAOYSA-N
XLogP0.71
TPSA69.64 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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

Analyze 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane?
The IUPAC name of 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane (CID 65113460) is 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane.
What is the SMILES notation for 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane?
The canonical SMILES for 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane is CCN(CC)S(=O)(=O)NCC(O)(CC)CC.
What is the InChIKey of 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane?
The InChIKey is DAGVNAXTGMDINJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O3S/c1-5-10(13,6-2)9-11-16(14,15)12(7-3)8-4/h11,13H,5-9H2,1-4H3.
What are the key properties of 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane?
3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane has a molecular weight of 252.38 g/mol, XLogP of 0.71, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(diethylsulfamoylamino)methyl]-3-hydroxypentane is sourced from PubChem (CID 65113460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).