N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide

C18H30N2O4S — CID 55796377

IUPACN-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)CCc1ccc(S(=O)(=O)NC)cc1
InChIInChI=1S/C18H30N2O4S/c1-5-16(6-2)20(13-14-24-4)18(21)12-9-15-7-10-17(11-8-15)25(22,23)19-3/h7-8,10-11,16,19H,5-6,9,12-14H2,1-4H3
InChIKeyVHZDNBYWBXMQBR-UHFFFAOYSA-N
MW370.52 g/mol
LogP2.19
Rot. Bonds11

About N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide

N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide (PubChem CID 55796377) has the molecular formula C18H30N2O4S and a molecular weight of 370.52 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide
PubChem CID55796377
Molecular FormulaC18H30N2O4S
Molecular Weight370.52 g/mol
Exact Mass370.19
IUPAC NameN-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide
SMILESCCC(CC)N(CCOC)C(=O)CCc1ccc(S(=O)(=O)NC)cc1
InChIInChI=1S/C18H30N2O4S/c1-5-16(6-2)20(13-14-24-4)18(21)12-9-15-7-10-17(11-8-15)25(22,23)19-3/h7-8,10-11,16,19H,5-6,9,12-14H2,1-4H3
InChIKeyVHZDNBYWBXMQBR-UHFFFAOYSA-N
XLogP2.19
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.52
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-methoxypropyl)-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51180667
N-(2-methoxyethyl)-2-(4-methylphenyl)-N-pentan-3-ylacetamide
CID 86982114
2-[2-methylpropyl-[3-[4-(methylsulfamoyl)phenyl]propanoyl]amino]acetic acid
CID 119192719
N-methyl-N-[2-(4-methylphenoxy)ethyl]-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 26994681
(2S,3S)-3-methyl-2-[3-[4-(methylsulfamoyl)phenyl]propanoylamino]pentanoic acid
CID 119193799
N-cyclohexyl-N-methyl-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51191477
N-methyl-3-[4-(methylsulfamoyl)phenyl]-N-(2-pyridin-4-ylethyl)propanamide
CID 90649211
2-[benzyl-[3-[4-(ethylsulfamoyl)phenyl]propanoyl]amino]-N-(2-methoxyethyl)-3-phenylpropanamide
CID 133213817
2-[benzyl-[3-[4-(ethylsulfamoyl)phenyl]propanoyl]amino]-N-(2-methoxyethyl)propanamide
CID 133148681
N-methyl-N-[(4-methylphenyl)methyl]-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 18114332
N-[1-(4-methoxyphenyl)propyl]-3-[4-(methylsulfamoyl)phenyl]propanamide
CID 51187566
2-[3-[4-(ethylsulfamoyl)phenyl]propanoyl-[(4-fluorophenyl)methyl]amino]-N-(3-methoxypropyl)propanamide
CID 133149680

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide?
The IUPAC name of N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide (CID 55796377) is N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide?
The canonical SMILES for N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide is CCC(CC)N(CCOC)C(=O)CCc1ccc(S(=O)(=O)NC)cc1.
What is the InChIKey of N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide?
The InChIKey is VHZDNBYWBXMQBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2O4S/c1-5-16(6-2)20(13-14-24-4)18(21)12-9-15-7-10-17(11-8-15)25(22,23)19-3/h7-8,10-11,16,19H,5-6,9,12-14H2,1-4H3.
What are the key properties of N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide?
N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide has a molecular weight of 370.52 g/mol, XLogP of 2.19, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-[4-(methylsulfamoyl)phenyl]-N-pentan-3-ylpropanamide is sourced from PubChem (CID 55796377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).