(2-methylimidazo[1,2-a]pyridin-3-yl)methanol

CAS Number: 30489-44-2
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Cc1c(CO)n(cccc2)c2n1
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
C9H10N2O
Molecular Weight
162.191
Drug-likeness
1.576
CAS
30489-44-2
InChI key
SEKFTKBRYHPGEI-UHFFFAOYSA-N
SMILES
Cc1c(CO)n(cccc2)c2n1
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 30489-44-2
Molecule Name (2-methylimidazo[1,2-a]pyridin-3-yl)methanol
Molecular Formula C9H10N2O
SMILES Cc1c(CO)n(cccc2)c2n1
InChI InChI=1S/C9H10N2O/c1-7-8(6-12)11-5-3-2-4-9(11)10-7/h2-5,12H,6H2,1H3
InChI Key SEKFTKBRYHPGEI-UHFFFAOYSA-N
CanonicalSyTyLFy 25ebd951966642a7
TotalMolweight 162.191
Molecular Weight 162.191
MonoisotopicMass 162.079313
CLogP 0.4567
CLogS -3.173
H Acceptors 3
H Donors 1
TotalSurfaceArea 129.64
Relative PSA 0.24699
PolarSurfaceArea 37.53
Drug-likeness 1.576
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.58333
Molecula Flexibility 0.16888
Molecular Complexity 0.79652
Fragments 1
Non HAtoms 12
NonCHAtoms 3
Electronegative Atoms 3
Rotatable Bond 1
Rings Closures 2
Small Rings 2
Aromatic Rings 2
Aromatic Atoms 9
Sp3Atoms 3
Aromatic Nitrogens 2
BasicNitrogens 1

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