8-propan-2-yloxyindolizine

C11H13NO — CID 12929991

IUPAC8-propan-2-yloxyindolizine
SMILESCC(C)Oc1cccn2cccc12
InChIInChI=1S/C11H13NO/c1-9(2)13-11-6-4-8-12-7-3-5-10(11)12/h3-9H,1-2H3
InChIKeyVITMBAHSLUYTNV-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.73
Rot. Bonds2

About 8-propan-2-yloxyindolizine

8-propan-2-yloxyindolizine (PubChem CID 12929991) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 8-propan-2-yloxyindolizine.

Molecular Properties

Compound Name8-propan-2-yloxyindolizine
PubChem CID12929991
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name8-propan-2-yloxyindolizine
SMILESCC(C)Oc1cccn2cccc12
InChIInChI=1S/C11H13NO/c1-9(2)13-11-6-4-8-12-7-3-5-10(11)12/h3-9H,1-2H3
InChIKeyVITMBAHSLUYTNV-UHFFFAOYSA-N
XLogP2.73
TPSA13.64 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-propan-2-yloxyindolizine?
The IUPAC name of 8-propan-2-yloxyindolizine (CID 12929991) is 8-propan-2-yloxyindolizine.
What is the SMILES notation for 8-propan-2-yloxyindolizine?
The canonical SMILES for 8-propan-2-yloxyindolizine is CC(C)Oc1cccn2cccc12.
What is the InChIKey of 8-propan-2-yloxyindolizine?
The InChIKey is VITMBAHSLUYTNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-9(2)13-11-6-4-8-12-7-3-5-10(11)12/h3-9H,1-2H3.
What are the key properties of 8-propan-2-yloxyindolizine?
8-propan-2-yloxyindolizine has a molecular weight of 175.23 g/mol, XLogP of 2.73, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-propan-2-yloxyindolizine is sourced from PubChem (CID 12929991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).