1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide

C15H24N2O2S — CID 106055064

IUPAC1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide
SMILESCCC(NS(=O)(=O)C(C)CNC1CC1)c1ccccc1
InChIInChI=1S/C15H24N2O2S/c1-3-15(13-7-5-4-6-8-13)17-20(18,19)12(2)11-16-14-9-10-14/h4-8,12,14-17H,3,9-11H2,1-2H3
InChIKeyQXNFNAFRDNOLRM-UHFFFAOYSA-N
MW296.44 g/mol
LogP2.20
Rot. Bonds8

About 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide

1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide (PubChem CID 106055064) has the molecular formula C15H24N2O2S and a molecular weight of 296.44 g/mol. Its IUPAC name is 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide.

Molecular Properties

Compound Name1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide
PubChem CID106055064
Molecular FormulaC15H24N2O2S
Molecular Weight296.44 g/mol
Exact Mass296.16
IUPAC Name1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide
SMILESCCC(NS(=O)(=O)C(C)CNC1CC1)c1ccccc1
InChIInChI=1S/C15H24N2O2S/c1-3-15(13-7-5-4-6-8-13)17-20(18,19)12(2)11-16-14-9-10-14/h4-8,12,14-17H,3,9-11H2,1-2H3
InChIKeyQXNFNAFRDNOLRM-UHFFFAOYSA-N
XLogP2.20
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 ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(cyclopropylamino)-N-(1-thiophen-2-ylpropyl)propane-2-sulfonamide
CID 106053417
1-(cyclopropylamino)-N-[1-(3-fluorophenyl)ethyl]propane-2-sulfonamide
CID 106000348
N-[(1S)-1-phenylpropyl]methanesulfonamide
CID 11321835
N-(2-phenylpropyl)cyclopropanamine;hydrochloride
CID 17158330
1-(cyclopropylamino)-N-(3-phenoxypropyl)propane-2-sulfonamide
CID 106062024
1-(cyclopropylamino)-N-(6-methyl-2-pyridinyl)propane-2-sulfonamide
CID 106086856
1-(cyclopropylamino)-N-(1-methylsulfanylpropan-2-yl)propane-2-sulfonamide
CID 106079574
1-(cyclopropylamino)-N-(1-cyclopropylpropan-2-yl)propane-2-sulfonamide
CID 106065688
1-N-cyclopropyl-2-N-(2-phenylbutyl)propane-1,2-diamine
CID 113407445
1-(cyclopropylamino)-N-[1-(dimethylamino)propan-2-yl]propane-2-sulfonamide
CID 106074303
1-(cyclopropylamino)-N-(4-propylphenyl)propane-2-sulfonamide
CID 106026307
N-(2-phenylbutyl)cyclopentanamine
CID 60664890

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide?
The IUPAC name of 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide (CID 106055064) is 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide.
What is the SMILES notation for 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide?
The canonical SMILES for 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide is CCC(NS(=O)(=O)C(C)CNC1CC1)c1ccccc1.
What is the InChIKey of 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide?
The InChIKey is QXNFNAFRDNOLRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2S/c1-3-15(13-7-5-4-6-8-13)17-20(18,19)12(2)11-16-14-9-10-14/h4-8,12,14-17H,3,9-11H2,1-2H3.
What are the key properties of 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide?
1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide has a molecular weight of 296.44 g/mol, XLogP of 2.20, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylamino)-N-(1-phenylpropyl)propane-2-sulfonamide is sourced from PubChem (CID 106055064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).