7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol

C9H15NO — CID 142154446

IUPAC7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol
SMILESCC1=CCN2CC(O)CC2C1
InChIInChI=1S/C9H15NO/c1-7-2-3-10-6-9(11)5-8(10)4-7/h2,8-9,11H,3-6H2,1H3
InChIKeySGUHEHAHHBADJV-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.77
Rot. Bonds

About 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol

7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol (PubChem CID 142154446) has the molecular formula C9H15NO and a molecular weight of 153.23 g/mol. Its IUPAC name is 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol.

Molecular Properties

Compound Name7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol
PubChem CID142154446
Molecular FormulaC9H15NO
Molecular Weight153.23 g/mol
Exact Mass153.12
IUPAC Name7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol
SMILESCC1=CCN2CC(O)CC2C1
InChIInChI=1S/C9H15NO/c1-7-2-3-10-6-9(11)5-8(10)4-7/h2,8-9,11H,3-6H2,1H3
InChIKeySGUHEHAHHBADJV-UHFFFAOYSA-N
XLogP0.77
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(6S,7aS)-6-methoxy-1-methyl-2,3,5,6,7,7a-hexahydroindole
CID 86279075
(6S,7aS)-1-methyl-2,3,5,6,7,7a-hexahydroindol-6-ol
CID 118709205
[(8aS)-1,2,3,5,6,8a-hexahydroindolizin-8-yl]methanol
CID 53483657
7-Methyl-2,3,5,7a-tetrahydro-1h-pyrrolizin-1-ol
CID 247727
1,2,3,5,6,8a-Hexahydroindolizin-8-ylmethanol
CID 11804970
2-[1-(1-Cyclohexenylmethyl) 2-pyrrolidinyl]ethanol
CID 13507086
(1R,8R)-7-methyl-2,3,5,8-tetrahydro-1H-pyrrolizin-1-ol
CID 15346845
(3S,5S)-5-prop-1-en-2-yl-1-propylpyrrolidin-3-ol
CID 57673973
1-Methyl-5-prop-1-enylpyrrolidin-3-ol
CID 59936382
3-(Cyclohexen-1-yl)-2-pyrrolidin-1-ylpropan-1-ol
CID 70484225
1-(Cyclohexen-1-yl)-3-pyrrolidin-1-ylpropan-2-ol
CID 70485481
(1R)-7-methyl-2,3,5,8-tetrahydro-1H-pyrrolizin-1-ol
CID 70497518

Frequently Asked Questions

What is the IUPAC name of 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol?
The IUPAC name of 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol (CID 142154446) is 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol.
What is the SMILES notation for 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol?
The canonical SMILES for 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol is CC1=CCN2CC(O)CC2C1.
What is the InChIKey of 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol?
The InChIKey is SGUHEHAHHBADJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO/c1-7-2-3-10-6-9(11)5-8(10)4-7/h2,8-9,11H,3-6H2,1H3.
What are the key properties of 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol?
7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol has a molecular weight of 153.23 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-1,2,3,5,8,8a-hexahydroindolizin-2-ol is sourced from PubChem (CID 142154446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).