(2-Amino-1-phenylethyl)dimethylamine

CAS Number: 6342-21-8
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CN(C)C(CN)c1ccccc1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C10H16N2
Molecular Weight
164.251
Drug-likeness
1.8441
CAS
6342-21-8
InChI key
NFSAPTWLWWYADB-JTQLQIEISA-N
SMILES
CN(C)C(CN)c1ccccc1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 6342-21-8
Molecule Name (2-Amino-1-phenylethyl)dimethylamine
Molecular Formula C10H16N2
SMILES CN(C)C(CN)c1ccccc1
InChI InChI=1S/C10H16N2/c1-12(2)10(8-11)9-6-4-3-5-7-9/h3-7,10H,8,11H2,1-2H3/t10-/m0/s1
InChI Key NFSAPTWLWWYADB-JTQLQIEISA-N
CanonicalSyTyLFy 29b365230153d0a0
TotalMolweight 164.251
Molecular Weight 164.251
MonoisotopicMass 164.131348
CLogP 0.2447
CLogS -0.77
H Acceptors 2
H Donors 1
TotalSurfaceArea 142.86
Relative PSA 0.13174
PolarSurfaceArea 29.26
Drug-likeness 1.8441
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.58333
Molecula Flexibility 0.63788
Molecular Complexity 0.53648
Fragments 1
Non HAtoms 12
NonCHAtoms 2
Electronegative Atoms 2
StereoCenters 1
Rotatable Bond 3
Rings Closures 1
Small Rings 1
Aromatic Rings 1
Aromatic Atoms 6
Sp3Atoms 6
Symmetricatoms 3
Amines 2
AlkylAmines 2
BasicNitrogens 2
StereoCon racemate

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