Lidocaine methiodide

CAS Number: 1462-71-1
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CC[N+](C)(C)CC(Nc1c(C)cccc1C)=O.[I-]
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
I.C14H23N2O
Molecular Weight
235.35
Drug-likeness
1.5045
CAS
1462-71-1
InChI key
OBZFQPPTRWTILY-UHFFFAOYSA-N
SMILES
CC[N+](C)(C)CC(Nc1c(C)cccc1C)=O.[I-]
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 1462-71-1
Molecule Name Lidocaine methiodide
Molecular Formula I.C14H23N2O
SMILES CC[N+](C)(C)CC(Nc1c(C)cccc1C)=O.[I-]
InChI InChI=1S/C14H22N2O.HI/c1-6-16(4,5)10-13(17)15-14-11(2)8-7-9-12(14)3;/h7-9H,6,10H2,1-5H3;1H
InChI Key OBZFQPPTRWTILY-UHFFFAOYSA-N
CanonicalSyTyLFy af55981148bc9cb0
TotalMolweight 362.25
Molecular Weight 235.35
MonoisotopicMass 235.181038
CLogP -1.1869
CLogS -1.804
H Acceptors 3
H Donors 1
TotalSurfaceArea 197.17
Relative PSA 0.085611
PolarSurfaceArea 29.1
Drug-likeness 1.5045
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Nasty Functions quart. ammonium
Shape Index 0.58824
Molecula Flexibility 0.59769
Molecular Complexity 0.58727
Fragments 2
Non HAtoms 17
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 4
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 8
Symmetricatoms 4
Amides 1
Amines 1
AlkylAmines 1

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