Pramiracetam hydrochloride

CAS Number: 75733-50-5
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CC(C)N(CCNC(CN(CCC1)C1=O)=O)C(C)C.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: high
Formula
HCl.C14H27N3O2
Molecular Weight
269.387
Drug-likeness
4.0736
CAS
75733-50-5
InChI key
SVIFGEVWHFNGCZ-UHFFFAOYSA-N
SMILES
CC(C)N(CCNC(CN(CCC1)C1=O)=O)C(C)C.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: high | Reproductive effective: none
PropertyValue
CAS Number 75733-50-5
Molecule Name Pramiracetam hydrochloride
Molecular Formula HCl.C14H27N3O2
SMILES CC(C)N(CCNC(CN(CCC1)C1=O)=O)C(C)C.Cl
InChI InChI=1S/C14H27N3O2.ClH/c1-11(2)17(12(3)4)9-7-15-13(18)10-16-8-5-6-14(16)19;/h11-12H,5-10H2,1-4H3,(H,15,18);1H
InChI Key SVIFGEVWHFNGCZ-UHFFFAOYSA-N
CanonicalSyTyLFy fa5bd41b8b8b10c3
TotalMolweight 305.848
Molecular Weight 269.387
MonoisotopicMass 269.210327
CLogP 0.4039
CLogS -1.021
H Acceptors 5
H Donors 1
TotalSurfaceArea 224.16
Relative PSA 0.19914
PolarSurfaceArea 52.65
Drug-likeness 4.0736
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant high
Shape Index 0.57895
Molecula Flexibility 0.71448
Molecular Complexity 0.58491
Fragments 2
Non HAtoms 19
NonCHAtoms 5
Electronegative Atoms 5
Rotatable Bond 7
Rings Closures 1
Small Rings 1
Sp3Atoms 13
Symmetricatoms 4
Amides 2
Amines 1
AlkylAmines 1
BasicNitrogens 1

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