2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol

C12H15NO — CID 118712363

IUPAC2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol
SMILESOc1ccc2c(c1)C1NCCCC1C2
InChIInChI=1S/C12H15NO/c14-10-4-3-8-6-9-2-1-5-13-12(9)11(8)7-10/h3-4,7,9,12-14H,1-2,5-6H2
InChIKeyIYBRRNJPOMRINZ-UHFFFAOYSA-N
MW189.26 g/mol
LogP1.99
Rot. Bonds

About 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol

2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol (PubChem CID 118712363) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol.

Molecular Properties

Compound Name2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol
PubChem CID118712363
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol
SMILESOc1ccc2c(c1)C1NCCCC1C2
InChIInChI=1S/C12H15NO/c14-10-4-3-8-6-9-2-1-5-13-12(9)11(8)7-10/h3-4,7,9,12-14H,1-2,5-6H2
InChIKeyIYBRRNJPOMRINZ-UHFFFAOYSA-N
XLogP1.99
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol?
The IUPAC name of 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol (CID 118712363) is 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol.
What is the SMILES notation for 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol?
The canonical SMILES for 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol is Oc1ccc2c(c1)C1NCCCC1C2.
What is the InChIKey of 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol?
The InChIKey is IYBRRNJPOMRINZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c14-10-4-3-8-6-9-2-1-5-13-12(9)11(8)7-10/h3-4,7,9,12-14H,1-2,5-6H2.
What are the key properties of 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol?
2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol has a molecular weight of 189.26 g/mol, XLogP of 1.99, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4,4a,5,9b-hexahydro-1H-indeno[1,2-b]pyridin-8-ol is sourced from PubChem (CID 118712363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).