[(5S)-5,6-dihydroindolizin-5-yl]methanol

C9H11NO — CID 45088225

IUPAC[(5S)-5,6-dihydroindolizin-5-yl]methanol
SMILESOC[C@@H]1CC=Cc2cccn21
InChIInChI=1S/C9H11NO/c11-7-9-4-1-3-8-5-2-6-10(8)9/h1-3,5-6,9,11H,4,7H2/t9-/m0/s1
InChIKeyRDJCVWHWWOWDGF-VIFPVBQESA-N
MW149.19 g/mol
LogP1.44
Rot. Bonds1

About [(5S)-5,6-dihydroindolizin-5-yl]methanol

[(5S)-5,6-dihydroindolizin-5-yl]methanol (PubChem CID 45088225) has the molecular formula C9H11NO and a molecular weight of 149.19 g/mol. Its IUPAC name is [(5S)-5,6-dihydroindolizin-5-yl]methanol.

Molecular Properties

Compound Name[(5S)-5,6-dihydroindolizin-5-yl]methanol
PubChem CID45088225
Molecular FormulaC9H11NO
Molecular Weight149.19 g/mol
Exact Mass149.08
IUPAC Name[(5S)-5,6-dihydroindolizin-5-yl]methanol
SMILESOC[C@@H]1CC=Cc2cccn21
InChIInChI=1S/C9H11NO/c11-7-9-4-1-3-8-5-2-6-10(8)9/h1-3,5-6,9,11H,4,7H2/t9-/m0/s1
InChIKeyRDJCVWHWWOWDGF-VIFPVBQESA-N
XLogP1.44
TPSA25.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.19
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(5S)-5,6-dihydroindolizin-5-yl]methanol?
The IUPAC name of [(5S)-5,6-dihydroindolizin-5-yl]methanol (CID 45088225) is [(5S)-5,6-dihydroindolizin-5-yl]methanol.
What is the SMILES notation for [(5S)-5,6-dihydroindolizin-5-yl]methanol?
The canonical SMILES for [(5S)-5,6-dihydroindolizin-5-yl]methanol is OC[C@@H]1CC=Cc2cccn21.
What is the InChIKey of [(5S)-5,6-dihydroindolizin-5-yl]methanol?
The InChIKey is RDJCVWHWWOWDGF-VIFPVBQESA-N. The full InChI is InChI=1S/C9H11NO/c11-7-9-4-1-3-8-5-2-6-10(8)9/h1-3,5-6,9,11H,4,7H2/t9-/m0/s1.
What are the key properties of [(5S)-5,6-dihydroindolizin-5-yl]methanol?
[(5S)-5,6-dihydroindolizin-5-yl]methanol has a molecular weight of 149.19 g/mol, XLogP of 1.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(5S)-5,6-dihydroindolizin-5-yl]methanol is sourced from PubChem (CID 45088225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).