N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide

C14H20N2O5S — CID 43037721

IUPACN-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C14H20N2O5S/c1-20-7-8-21-10-14(17)15-12-3-2-4-13(9-12)22(18,19)16-11-5-6-11/h2-4,9,11,16H,5-8,10H2,1H3,(H,15,17)
InChIKeyPTUTYHFHSFKCNX-UHFFFAOYSA-N
MW328.39 g/mol
LogP0.73
Rot. Bonds9

About N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide

N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide (PubChem CID 43037721) has the molecular formula C14H20N2O5S and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide.

Molecular Properties

Compound NameN-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide
PubChem CID43037721
Molecular FormulaC14H20N2O5S
Molecular Weight328.39 g/mol
Exact Mass328.11
IUPAC NameN-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide
SMILESCOCCOCC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C14H20N2O5S/c1-20-7-8-21-10-14(17)15-12-3-2-4-13(9-12)22(18,19)16-11-5-6-11/h2-4,9,11,16H,5-8,10H2,1H3,(H,15,17)
InChIKeyPTUTYHFHSFKCNX-UHFFFAOYSA-N
XLogP0.73
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N-[3-(cyclopropylsulfamoyl)phenyl]-2-(propan-2-ylamino)acetamide
CID 60718564
5-bromo-N-[3-(cyclopropylsulfamoyl)phenyl]pentanamide
CID 107907884
methyl 2-[3-[[3-(cyclopropylsulfamoyl)phenyl]carbamoyl]phenoxy]acetate
CID 55871864
5-chloro-N-[3-(cyclopropylsulfamoyl)phenyl]pentanamide
CID 43347060
2-methoxy-N-[3-(methylsulfamoyl)phenyl]acetamide
CID 47175857
N-[3-[3-(cyclopropylsulfamoyl)anilino]-3-oxopropyl]-2,2-dimethylpropanamide
CID 24655241
4-bromo-N-[3-[3-(cyclopropylsulfamoyl)anilino]-3-oxopropyl]benzamide
CID 24582386
N-[3-(cyclopropylsulfamoyl)phenyl]-2-methyl-3-(methylamino)propanamide
CID 79203861
N-[3-(cyclohexylsulfamoyl)phenyl]acetamide
CID 47314930
(2R)-2-amino-N-[3-(cyclopropylsulfamoyl)phenyl]propanamide
CID 54995716
3-amino-N-[3-(cyclopropylsulfamoyl)phenyl]-2,2-dimethylpropanamide
CID 81486538
N-[3-(cyclopropylsulfamoyl)phenyl]-4-(4-fluorophenyl)-4-oxobutanamide
CID 38140750

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide?
The IUPAC name of N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide (CID 43037721) is N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide.
What is the SMILES notation for N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide?
The canonical SMILES for N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide is COCCOCC(=O)Nc1cccc(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide?
The InChIKey is PTUTYHFHSFKCNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O5S/c1-20-7-8-21-10-14(17)15-12-3-2-4-13(9-12)22(18,19)16-11-5-6-11/h2-4,9,11,16H,5-8,10H2,1H3,(H,15,17).
What are the key properties of N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide?
N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide has a molecular weight of 328.39 g/mol, XLogP of 0.73, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylsulfamoyl)phenyl]-2-(2-methoxyethoxy)acetamide is sourced from PubChem (CID 43037721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).