N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide

C15H22N2O3S — CID 115591226

IUPACN-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide
SMILESCC(CNC(=O)CCc1ccc(S(N)(=O)=O)cc1)C1CC1
InChIInChI=1S/C15H22N2O3S/c1-11(13-5-6-13)10-17-15(18)9-4-12-2-7-14(8-3-12)21(16,19)20/h2-3,7-8,11,13H,4-6,9-10H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyFHTDOIPZOYEBGI-UHFFFAOYSA-N
MW310.42 g/mol
LogP1.43
Rot. Bonds7

About N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide

N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide (PubChem CID 115591226) has the molecular formula C15H22N2O3S and a molecular weight of 310.42 g/mol. Its IUPAC name is N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide.

Molecular Properties

Compound NameN-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide
PubChem CID115591226
Molecular FormulaC15H22N2O3S
Molecular Weight310.42 g/mol
Exact Mass310.14
IUPAC NameN-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide
SMILESCC(CNC(=O)CCc1ccc(S(N)(=O)=O)cc1)C1CC1
InChIInChI=1S/C15H22N2O3S/c1-11(13-5-6-13)10-17-15(18)9-4-12-2-7-14(8-3-12)21(16,19)20/h2-3,7-8,11,13H,4-6,9-10H2,1H3,(H,17,18)(H2,16,19,20)
InChIKeyFHTDOIPZOYEBGI-UHFFFAOYSA-N
XLogP1.43
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.42
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide?
The IUPAC name of N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide (CID 115591226) is N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide.
What is the SMILES notation for N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide?
The canonical SMILES for N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide is CC(CNC(=O)CCc1ccc(S(N)(=O)=O)cc1)C1CC1.
What is the InChIKey of N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide?
The InChIKey is FHTDOIPZOYEBGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3S/c1-11(13-5-6-13)10-17-15(18)9-4-12-2-7-14(8-3-12)21(16,19)20/h2-3,7-8,11,13H,4-6,9-10H2,1H3,(H,17,18)(H2,16,19,20).
What are the key properties of N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide?
N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide has a molecular weight of 310.42 g/mol, XLogP of 1.43, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopropylpropyl)-3-(4-sulfamoylphenyl)propanamide is sourced from PubChem (CID 115591226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).