2H-pyran;4H-quinolizine

C14H15NO — CID 87901713

IUPAC2H-pyran;4H-quinolizine
SMILESC1=CCN2C=CC=CC2=C1.C1=CCOC=C1
InChIInChI=1S/C9H9N.C5H6O/c1-3-7-10-8-4-2-6-9(10)5-1;1-2-4-6-5-3-1/h1-7H,8H2;1-4H,5H2
InChIKeyLJUNSQSXQKCYTB-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.91
Rot. Bonds

About 2H-pyran;4H-quinolizine

2H-pyran;4H-quinolizine (PubChem CID 87901713) has the molecular formula C14H15NO and a molecular weight of 213.28 g/mol. Its IUPAC name is 2H-pyran;4H-quinolizine.

Molecular Properties

Compound Name2H-pyran;4H-quinolizine
PubChem CID87901713
Molecular FormulaC14H15NO
Molecular Weight213.28 g/mol
Exact Mass213.12
IUPAC Name2H-pyran;4H-quinolizine
SMILESC1=CCN2C=CC=CC2=C1.C1=CCOC=C1
InChIInChI=1S/C9H9N.C5H6O/c1-3-7-10-8-4-2-6-9(10)5-1;1-2-4-6-5-3-1/h1-7H,8H2;1-4H,5H2
InChIKeyLJUNSQSXQKCYTB-UHFFFAOYSA-N
XLogP2.91
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2H-pyran;4H-quinolizine?
The IUPAC name of 2H-pyran;4H-quinolizine (CID 87901713) is 2H-pyran;4H-quinolizine.
What is the SMILES notation for 2H-pyran;4H-quinolizine?
The canonical SMILES for 2H-pyran;4H-quinolizine is C1=CCN2C=CC=CC2=C1.C1=CCOC=C1.
What is the InChIKey of 2H-pyran;4H-quinolizine?
The InChIKey is LJUNSQSXQKCYTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N.C5H6O/c1-3-7-10-8-4-2-6-9(10)5-1;1-2-4-6-5-3-1/h1-7H,8H2;1-4H,5H2.
What are the key properties of 2H-pyran;4H-quinolizine?
2H-pyran;4H-quinolizine has a molecular weight of 213.28 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-pyran;4H-quinolizine is sourced from PubChem (CID 87901713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).