4-(ethylsulfamoylamino)-1-methoxybutan-2-ol

C7H18N2O4S — CID 103875951

IUPAC4-(ethylsulfamoylamino)-1-methoxybutan-2-ol
SMILESCCNS(=O)(=O)NCCC(O)COC
InChIInChI=1S/C7H18N2O4S/c1-3-8-14(11,12)9-5-4-7(10)6-13-2/h7-10H,3-6H2,1-2H3
InChIKeyQAXSKLOOIVYWTB-UHFFFAOYSA-N
MW226.30 g/mol
LogP-1.17
Rot. Bonds8

About 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol

4-(ethylsulfamoylamino)-1-methoxybutan-2-ol (PubChem CID 103875951) has the molecular formula C7H18N2O4S and a molecular weight of 226.30 g/mol. Its IUPAC name is 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol.

Molecular Properties

Compound Name4-(ethylsulfamoylamino)-1-methoxybutan-2-ol
PubChem CID103875951
Molecular FormulaC7H18N2O4S
Molecular Weight226.30 g/mol
Exact Mass226.10
IUPAC Name4-(ethylsulfamoylamino)-1-methoxybutan-2-ol
SMILESCCNS(=O)(=O)NCCC(O)COC
InChIInChI=1S/C7H18N2O4S/c1-3-8-14(11,12)9-5-4-7(10)6-13-2/h7-10H,3-6H2,1-2H3
InChIKeyQAXSKLOOIVYWTB-UHFFFAOYSA-N
XLogP-1.17
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.30
LogP ≤ 5-1.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol 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 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol?
The IUPAC name of 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol (CID 103875951) is 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol.
What is the SMILES notation for 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol?
The canonical SMILES for 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol is CCNS(=O)(=O)NCCC(O)COC.
What is the InChIKey of 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol?
The InChIKey is QAXSKLOOIVYWTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O4S/c1-3-8-14(11,12)9-5-4-7(10)6-13-2/h7-10H,3-6H2,1-2H3.
What are the key properties of 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol?
4-(ethylsulfamoylamino)-1-methoxybutan-2-ol has a molecular weight of 226.30 g/mol, XLogP of -1.17, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylsulfamoylamino)-1-methoxybutan-2-ol is sourced from PubChem (CID 103875951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).