ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate

C10H14N2O4S — CID 61063184

IUPACethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C10H14N2O4S/c1-3-16-10(13)12-9-6-8(17(11,14)15)5-4-7(9)2/h4-6H,3H2,1-2H3,(H,12,13)(H2,11,14,15)
InChIKeyCMLROGRUPBWDNB-UHFFFAOYSA-N
MW258.30 g/mol
LogP1.21
Rot. Bonds3

About ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate

ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate (PubChem CID 61063184) has the molecular formula C10H14N2O4S and a molecular weight of 258.30 g/mol. Its IUPAC name is ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate.

Molecular Properties

Compound Nameethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
PubChem CID61063184
Molecular FormulaC10H14N2O4S
Molecular Weight258.30 g/mol
Exact Mass258.07
IUPAC Nameethyl N-(2-methyl-5-sulfamoylphenyl)carbamate
SMILESCCOC(=O)Nc1cc(S(N)(=O)=O)ccc1C
InChIInChI=1S/C10H14N2O4S/c1-3-16-10(13)12-9-6-8(17(11,14)15)5-4-7(9)2/h4-6H,3H2,1-2H3,(H,12,13)(H2,11,14,15)
InChIKeyCMLROGRUPBWDNB-UHFFFAOYSA-N
XLogP1.21
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.30
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
CID 55103402
(2S)-2-amino-3-methyl-N-(2-methyl-5-sulfamoylphenyl)pentanamide
CID 61172312
2-cyano-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 168521039
(2-methyl-5-sulfamoylphenyl)thiourea
CID 169356925
ethyl N-(5-ethyl-2-methylphenyl)carbamate
CID 110604053
3,3,3-trifluoro-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 61130873
2-(cyclopropylmethylamino)-N-(2-methyl-5-sulfamoylphenyl)acetamide
CID 60866226
3-chloro-2-methyl-N-(2-methyl-5-sulfamoylphenyl)propanamide
CID 62727205
methyl 3-(ethoxycarbonylamino)-4-methylbenzoate
CID 3309818
(2R)-2-amino-3-methyl-N-(2-methyl-5-sulfamoylphenyl)butanamide
CID 79013470
2-hydroxy-N-(2-methyl-5-sulfamoylphenyl)benzamide
CID 61129726
5-bromo-N-(2-methyl-5-sulfamoylphenyl)pentanamide
CID 107908940

Frequently Asked Questions

What is the IUPAC name of ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate?
The IUPAC name of ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate (CID 61063184) is ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate.
What is the SMILES notation for ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate?
The canonical SMILES for ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate is CCOC(=O)Nc1cc(S(N)(=O)=O)ccc1C.
What is the InChIKey of ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate?
The InChIKey is CMLROGRUPBWDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O4S/c1-3-16-10(13)12-9-6-8(17(11,14)15)5-4-7(9)2/h4-6H,3H2,1-2H3,(H,12,13)(H2,11,14,15).
What are the key properties of ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate?
ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate has a molecular weight of 258.30 g/mol, XLogP of 1.21, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(2-methyl-5-sulfamoylphenyl)carbamate is sourced from PubChem (CID 61063184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).