1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide

C15H24N2O2S — CID 106026307

IUPAC1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide
SMILESCCCc1ccc(NS(=O)(=O)C(C)CNC2CC2)cc1
InChIInChI=1S/C15H24N2O2S/c1-3-4-13-5-7-15(8-6-13)17-20(18,19)12(2)11-16-14-9-10-14/h5-8,12,14,16-17H,3-4,9-11H2,1-2H3
InChIKeyNZFJMXSIUAYSSD-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.52
Rot. Bonds8

About 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide

1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide (PubChem CID 106026307) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide
PubChem CID106026307
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide
SMILESCCCc1ccc(NS(=O)(=O)C(C)CNC2CC2)cc1
InChIInChI=1S/C15H24N2O2S/c1-3-4-13-5-7-15(8-6-13)17-20(18,19)12(2)11-16-14-9-10-14/h5-8,12,14,16-17H,3-4,9-11H2,1-2H3
InChIKeyNZFJMXSIUAYSSD-UHFFFAOYSA-N
XLogP2.52
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.44
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-N-(4-methoxyphenyl)propane-2-sulfonamide
CID 106031224
N-(3-chlorophenyl)-1-(cyclopropylamino)propane-2-sulfonamide
CID 106060415
2-[(4-propylphenyl)sulfamoyl]propanoic acid
CID 54947538
N-(4-ethylphenyl)-1-(propylamino)propane-2-sulfonamide
CID 107278431
1-(cyclopropylamino)-N-(6-methyl-2-pyridinyl)propane-2-sulfonamide
CID 106086856
1-(cyclopropylamino)-N-(2,3-dichlorophenyl)propane-2-sulfonamide
CID 106030643
N-(4-butylphenyl)-3-(cyclopropylamino)propane-1-sulfonamide
CID 106026055
N-(5-bromo-2-pyridinyl)-1-(cyclopropylamino)propane-2-sulfonamide
CID 106020370
1-(cyclopropylamino)-N-(pyridin-4-ylmethyl)propane-2-sulfonamide
CID 114138780
4-(propan-2-ylsulfonylamino)-N-(4-propylphenyl)piperidine-1-carboxamide
CID 20628957
N-[2-(4-propylphenoxy)propyl]cyclohexanamine
CID 63515427
1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide
CID 106055064

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide?
The IUPAC name of 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide (CID 106026307) is 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide.
What is the SMILES notation for 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide?
The canonical SMILES for 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide is CCCc1ccc(NS(=O)(=O)C(C)CNC2CC2)cc1.
What is the InChIKey of 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide?
The InChIKey is NZFJMXSIUAYSSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-3-4-13-5-7-15(8-6-13)17-20(18,19)12(2)11-16-14-9-10-14/h5-8,12,14,16-17H,3-4,9-11H2,1-2H3.
What are the key properties of 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide?
1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.52, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide is sourced from PubChem (CID 106026307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).