4-methylidenequinolizine

C10H9N — CID 58788768

IUPAC4-methylidenequinolizine
SMILESC=C1C=CC=C2C=CC=CN12
InChIInChI=1S/C10H9N/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H2
InChIKeyCOTBTTVFDIQZQI-UHFFFAOYSA-N
MW143.19 g/mol
LogP2.34
Rot. Bonds

About 4-methylidenequinolizine

4-methylidenequinolizine (PubChem CID 58788768) has the molecular formula C10H9N and a molecular weight of 143.19 g/mol. Its IUPAC name is 4-methylidenequinolizine.

Molecular Properties

Compound Name4-methylidenequinolizine
PubChem CID58788768
Molecular FormulaC10H9N
Molecular Weight143.19 g/mol
Exact Mass143.07
IUPAC Name4-methylidenequinolizine
SMILESC=C1C=CC=C2C=CC=CN12
InChIInChI=1S/C10H9N/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H2
InChIKeyCOTBTTVFDIQZQI-UHFFFAOYSA-N
XLogP2.34
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methylidenequinolizine?
The IUPAC name of 4-methylidenequinolizine (CID 58788768) is 4-methylidenequinolizine.
What is the SMILES notation for 4-methylidenequinolizine?
The canonical SMILES for 4-methylidenequinolizine is C=C1C=CC=C2C=CC=CN12.
What is the InChIKey of 4-methylidenequinolizine?
The InChIKey is COTBTTVFDIQZQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N/c1-9-5-4-7-10-6-2-3-8-11(9)10/h2-8H,1H2.
What are the key properties of 4-methylidenequinolizine?
4-methylidenequinolizine has a molecular weight of 143.19 g/mol, XLogP of 2.34, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidenequinolizine is sourced from PubChem (CID 58788768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).