[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol

C11H18N2O4S — CID 114815669

IUPAC[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol
SMILESCOCCNS(=O)(=O)NCc1cccc(CO)c1
InChIInChI=1S/C11H18N2O4S/c1-17-6-5-12-18(15,16)13-8-10-3-2-4-11(7-10)9-14/h2-4,7,12-14H,5-6,8-9H2,1H3
InChIKeyDYVLJKIBFIYCIO-UHFFFAOYSA-N
MW274.34 g/mol
LogP-0.25
Rot. Bonds8

About [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol

[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol (PubChem CID 114815669) has the molecular formula C11H18N2O4S and a molecular weight of 274.34 g/mol. Its IUPAC name is [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol.

Molecular Properties

Compound Name[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol
PubChem CID114815669
Molecular FormulaC11H18N2O4S
Molecular Weight274.34 g/mol
Exact Mass274.10
IUPAC Name[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol
SMILESCOCCNS(=O)(=O)NCc1cccc(CO)c1
InChIInChI=1S/C11H18N2O4S/c1-17-6-5-12-18(15,16)13-8-10-3-2-4-11(7-10)9-14/h2-4,7,12-14H,5-6,8-9H2,1H3
InChIKeyDYVLJKIBFIYCIO-UHFFFAOYSA-N
XLogP-0.25
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.34
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol 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

3-[(2-methoxyethylsulfamoylamino)methyl]phenol
CID 114815535
3-[(2-methoxyethylsulfamoylamino)methyl]benzoic acid
CID 114814467
3-[(2-methoxyethylsulfamoylamino)methyl]benzenecarboximidamide
CID 114816930
[3-[(propan-2-ylsulfamoylamino)methyl]phenyl]methanol
CID 115969766
2-methoxy-5-[(2-methoxyethylsulfamoylamino)methyl]aniline
CID 114814135
N-(2-methoxyethylsulfamoyl)-3-[(propan-2-ylamino)methyl]aniline
CID 106911371
N-[[3-(hydroxymethyl)phenyl]methyl]-3,4-dimethylbenzenesulfonamide
CID 63311640
[3-[[2-(3-methoxypropoxy)ethylamino]methyl]phenyl]methanol
CID 107230478
methyl 4-[[3-(hydroxymethyl)phenyl]methylsulfamoyl]butanoate
CID 63311717
3-fluoro-N-[[3-(hydroxymethyl)phenyl]methyl]propane-1-sulfonamide
CID 75387120
2-[[3-(hydroxymethyl)phenyl]methylamino]-N-(3-methoxypropyl)acetamide
CID 107230510
ethyl 2-[[3-(hydroxymethyl)phenyl]methylsulfamoyl]acetate
CID 63311718

Frequently Asked Questions

What is the IUPAC name of [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol?
The IUPAC name of [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol (CID 114815669) is [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol.
What is the SMILES notation for [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol?
The canonical SMILES for [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol is COCCNS(=O)(=O)NCc1cccc(CO)c1.
What is the InChIKey of [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol?
The InChIKey is DYVLJKIBFIYCIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O4S/c1-17-6-5-12-18(15,16)13-8-10-3-2-4-11(7-10)9-14/h2-4,7,12-14H,5-6,8-9H2,1H3.
What are the key properties of [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol?
[3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol has a molecular weight of 274.34 g/mol, XLogP of -0.25, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-[(2-methoxyethylsulfamoylamino)methyl]phenyl]methanol is sourced from PubChem (CID 114815669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).