2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate

C10H14N2O5S — CID 79349048

IUPAC2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate
SMILESNS(=O)(=O)c1cccc(CNC(=O)OCCO)c1
InChIInChI=1S/C10H14N2O5S/c11-18(15,16)9-3-1-2-8(6-9)7-12-10(14)17-5-4-13/h1-3,6,13H,4-5,7H2,(H,12,14)(H2,11,15,16)
InChIKeyBOBKIWMPOWXPIT-UHFFFAOYSA-N
MW274.30 g/mol
LogP-0.45
Rot. Bonds5

About 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate

2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate (PubChem CID 79349048) has the molecular formula C10H14N2O5S and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate.

Molecular Properties

Compound Name2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate
PubChem CID79349048
Molecular FormulaC10H14N2O5S
Molecular Weight274.30 g/mol
Exact Mass274.06
IUPAC Name2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate
SMILESNS(=O)(=O)c1cccc(CNC(=O)OCCO)c1
InChIInChI=1S/C10H14N2O5S/c11-18(15,16)9-3-1-2-8(6-9)7-12-10(14)17-5-4-13/h1-3,6,13H,4-5,7H2,(H,12,14)(H2,11,15,16)
InChIKeyBOBKIWMPOWXPIT-UHFFFAOYSA-N
XLogP-0.45
TPSA118.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 5-0.45
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-hydroxy-N-[(3-sulfamoylphenyl)methyl]butanamide
CID 79192761
2-methoxy-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 32567500
2-amino-2-methyl-N-[(3-sulfamoylphenyl)methyl]propanamide
CID 61265020
1-phenyl-3-[(3-sulfamoylphenyl)methyl]urea
CID 51970987
3-(hydroxymethyl)benzenesulfonamide
CID 23133799
N-[(3-sulfamoylphenyl)methyl]cyclopent-3-ene-1-carboxamide
CID 64766763
2-(methylamino)-N-[(3-sulfamoylphenyl)methyl]propanamide
CID 62638953
2-(cyclopropylmethylamino)-N-[(3-sulfamoylphenyl)methyl]acetamide
CID 60859149
3-chloro-2,2-dimethyl-N-[(3-sulfamoylphenyl)methyl]propanamide
CID 63680751
2-[2-oxo-2-[(3-sulfamoylphenyl)methylamino]ethyl]sulfanylacetic acid
CID 104569122
3-amino-N-[(3-sulfamoylphenyl)methyl]butanamide;hydrochloride
CID 119731394
3-bromo-N-[(3-sulfamoylphenyl)methyl]benzamide
CID 55641528

Frequently Asked Questions

What is the IUPAC name of 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate?
The IUPAC name of 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate (CID 79349048) is 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate.
What is the SMILES notation for 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate?
The canonical SMILES for 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate is NS(=O)(=O)c1cccc(CNC(=O)OCCO)c1.
What is the InChIKey of 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate?
The InChIKey is BOBKIWMPOWXPIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O5S/c11-18(15,16)9-3-1-2-8(6-9)7-12-10(14)17-5-4-13/h1-3,6,13H,4-5,7H2,(H,12,14)(H2,11,15,16).
What are the key properties of 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate?
2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate has a molecular weight of 274.30 g/mol, XLogP of -0.45, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyethyl N-[(3-sulfamoylphenyl)methyl]carbamate is sourced from PubChem (CID 79349048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).