3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide

C15H22N2O5S — CID 9439194

IUPAC3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C15H22N2O5S/c1-21-9-3-8-16-15(18)11-4-7-13(22-2)14(10-11)23(19,20)17-12-5-6-12/h4,7,10,12,17H,3,5-6,8-9H2,1-2H3,(H,16,18)
InChIKeyRHONVXCHJFJAPI-UHFFFAOYSA-N
MW342.42 g/mol
LogP0.90
Rot. Bonds9

About 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide

3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide (PubChem CID 9439194) has the molecular formula C15H22N2O5S and a molecular weight of 342.42 g/mol. Its IUPAC name is 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide.

Molecular Properties

Compound Name3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
PubChem CID9439194
Molecular FormulaC15H22N2O5S
Molecular Weight342.42 g/mol
Exact Mass342.12
IUPAC Name3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
SMILESCOCCCNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1
InChIInChI=1S/C15H22N2O5S/c1-21-9-3-8-16-15(18)11-4-7-13(22-2)14(10-11)23(19,20)17-12-5-6-12/h4,7,10,12,17H,3,5-6,8-9H2,1-2H3,(H,16,18)
InChIKeyRHONVXCHJFJAPI-UHFFFAOYSA-N
XLogP0.90
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.42
LogP ≤ 50.90
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

3-(cyclopropylsulfamoyl)-4-methoxy-N-[2-(methylamino)ethyl]benzamide
CID 119502368
3-(cyclopropylsulfamoyl)-4-methoxy-N-[3-(4-methoxyphenyl)propyl]benzamide
CID 55976665
3-(ethylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide
CID 45373616
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(methylamino)ethyl]benzamide;hydrochloride
CID 119501094
2-[4-[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]piperazin-1-yl]-N-(3-methoxypropyl)acetamide
CID 55428478
3-(cyclopentylsulfamoyl)-N-[3-(2,5-dioxopyrrolidin-1-yl)propyl]-4-methoxybenzamide
CID 56558795
3-[[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]amino]-2,2-dimethylpropanoic acid
CID 119249130
3-(cyclopentylsulfamoyl)-4-methoxy-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 27548348
3-(cyclopropylsulfamoyl)-4-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 46554772
N-(3-ethoxypropyl)-3-(ethylsulfamoyl)-4-methoxybenzamide
CID 45373708
cis-(1R,3S)-3-[[3-(cyclopropylsulfamoyl)-4-methoxybenzoyl]amino]cyclopentane-1-carboxylic acid
CID 120677585
3-(cyclopentylsulfamoyl)-4-methoxy-N-(4-methylcyclohexyl)benzamide
CID 2579929

Frequently Asked Questions

What is the IUPAC name of 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide?
The IUPAC name of 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide (CID 9439194) is 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide.
What is the SMILES notation for 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide?
The canonical SMILES for 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide is COCCCNC(=O)c1ccc(OC)c(S(=O)(=O)NC2CC2)c1.
What is the InChIKey of 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide?
The InChIKey is RHONVXCHJFJAPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O5S/c1-21-9-3-8-16-15(18)11-4-7-13(22-2)14(10-11)23(19,20)17-12-5-6-12/h4,7,10,12,17H,3,5-6,8-9H2,1-2H3,(H,16,18).
What are the key properties of 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide?
3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide has a molecular weight of 342.42 g/mol, XLogP of 0.90, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclopropylsulfamoyl)-4-methoxy-N-(3-methoxypropyl)benzamide is sourced from PubChem (CID 9439194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).