N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide

C12H17N3O5S — CID 82913324

IUPACN-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide
SMILESCc1cc(S(N)(=O)=O)c(C)cc1OC(C)C(=O)NC(N)=O
InChIInChI=1S/C12H17N3O5S/c1-6-5-10(21(14,18)19)7(2)4-9(6)20-8(3)11(16)15-12(13)17/h4-5,8H,1-3H3,(H2,14,18,19)(H3,13,15,16,17)
InChIKeyMOAIGIGJFOUEEB-UHFFFAOYSA-N
MW315.35 g/mol
LogP-0.09
Rot. Bonds4

About N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide

N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide (PubChem CID 82913324) has the molecular formula C12H17N3O5S and a molecular weight of 315.35 g/mol. Its IUPAC name is N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide.

Molecular Properties

Compound NameN-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide
PubChem CID82913324
Molecular FormulaC12H17N3O5S
Molecular Weight315.35 g/mol
Exact Mass315.09
IUPAC NameN-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide
SMILESCc1cc(S(N)(=O)=O)c(C)cc1OC(C)C(=O)NC(N)=O
InChIInChI=1S/C12H17N3O5S/c1-6-5-10(21(14,18)19)7(2)4-9(6)20-8(3)11(16)15-12(13)17/h4-5,8H,1-3H3,(H2,14,18,19)(H3,13,15,16,17)
InChIKeyMOAIGIGJFOUEEB-UHFFFAOYSA-N
XLogP-0.09
TPSA141.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.35
LogP ≤ 5-0.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide 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

2-(2,5-dimethyl-4-sulfamoylphenoxy)-N-methylpropanamide
CID 82912061
2-(4-amino-2,5-dimethylphenoxy)-N-carbamoylpropanamide
CID 63181045
2-(2,5-dimethyl-4-sulfamoylphenoxy)-N,N-dimethylpropanamide
CID 82912493
(2R)-N-carbamoyl-2-(4-chloro-2-methylphenoxy)propanamide
CID 8709006
N-carbamoyl-2-(5-cyano-2-methylphenoxy)propanamide
CID 107663137
2,5-dimethyl-4-pentan-2-yloxybenzenesulfonamide
CID 107896256
5-bromo-4-[1-(carbamoylamino)-1-oxopropan-2-yl]oxy-2-fluorobenzenesulfonyl chloride
CID 82912586
methyl 2-bromo-4-methyl-5-sulfamoylbenzoate
CID 18937264
2-methyl-5-propan-2-yl-4-propan-2-yloxybenzenesulfonamide
CID 43164355
4-[1-(carbamoylamino)-1-oxopropan-2-yl]oxy-2,3-difluorobenzenesulfonyl chloride
CID 82911539
2-(2-bromo-4-chlorophenoxy)-N-carbamoylpropanamide
CID 3901807
2-(2-methyl-4-sulfamoylphenoxy)-N-propan-2-ylpropanamide
CID 82921728

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide?
The IUPAC name of N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide (CID 82913324) is N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide.
What is the SMILES notation for N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide?
The canonical SMILES for N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide is Cc1cc(S(N)(=O)=O)c(C)cc1OC(C)C(=O)NC(N)=O.
What is the InChIKey of N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide?
The InChIKey is MOAIGIGJFOUEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O5S/c1-6-5-10(21(14,18)19)7(2)4-9(6)20-8(3)11(16)15-12(13)17/h4-5,8H,1-3H3,(H2,14,18,19)(H3,13,15,16,17).
What are the key properties of N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide?
N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide has a molecular weight of 315.35 g/mol, XLogP of -0.09, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-2-(2,5-dimethyl-4-sulfamoylphenoxy)propanamide is sourced from PubChem (CID 82913324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).