2-Methylimidazo[1,2-a]pyridin-8-amine--hydrogen chloride (1/1)

CAS Number: 173159-45-0
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Cc1cn(cccc2N)c2n1.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C8H9N3
Molecular Weight
147.18
Drug-likeness
1.5293
CAS
173159-45-0
InChI key
KAHZHPQAMUDHSL-UHFFFAOYSA-N
SMILES
Cc1cn(cccc2N)c2n1.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 173159-45-0
Molecule Name 2-Methylimidazo[1,2-a]pyridin-8-amine--hydrogen chloride (1/1)
Molecular Formula HCl.C8H9N3
SMILES Cc1cn(cccc2N)c2n1.Cl
InChI InChI=1S/C8H9N3.ClH/c1-6-5-11-4-2-3-7(9)8(11)10-6;/h2-5H,9H2,1H3;1H
InChI Key KAHZHPQAMUDHSL-UHFFFAOYSA-N
CanonicalSyTyLFy 99d4c274a5a685f7
TotalMolweight 183.641
Molecular Weight 147.18
MonoisotopicMass 147.079647
CLogP 0.3227
CLogS -3.341
H Acceptors 3
H Donors 1
TotalSurfaceArea 118.05
Relative PSA 0.28962
PolarSurfaceArea 43.32
Drug-likeness 1.5293
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.54545
Molecular Complexity 0.74811
Fragments 2
Non HAtoms 11
NonCHAtoms 3
Electronegative Atoms 3
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 9
Sp3Atoms 1
Amines 1
Aromatic Amines 1
Aromatic Nitrogens 2
BasicNitrogens 1

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