Molecular Identity
3-(Cyclohexylamino)-1-propanesulfonic acid
3-(cyclohexylamino)propane-1-sulfonic acid
PubChem CID: 70815
Cyclohexylaminopropanesulfonic acid is an amine.
2D Structure
Properties
C9H19NO3S
Molecular Formula
221.32
Molecular Weight
g/mol
221.1086
Exact Mass
Da
-1.4
XLogP
Drug-like (Lipinski: < 5)
74.8
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
239
Complexity
SMILES
Canonical SMILES
SMILES: C1CCC(CC1)NCCCS(=O)(=O)OIsomeric SMILES
SMILES: C1CCC(CC1)NCCCS(=O)(=O)OSynonyms(20)
CAPS1135-40-63-(Cyclohexylamino)-1-propanesulfonic acid3-(cyclohexylamino)propane-1-sulfonic acid1-Propanesulfonic acid, 3-(cyclohexylamino)-3-(Cyclohexylamino)propanesulfonic acidWAS-124W981O1LXPDTXSID3061554CAPS acidRefChem:494739DTXCID1033327214-492-13-Cyclohexylaminopropanesulfonic AcidN-Cyclohexyl-3-aminopropanesulfonic acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to 3-(Cyclohexylamino)-1-propanesulfonic acid
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