4H-quinolizin-3-amine

C9H10N2 — CID 57421862

IUPAC4H-quinolizin-3-amine
SMILESNC1=CC=C2C=CC=CN2C1
InChIInChI=1S/C9H10N2/c10-8-4-5-9-3-1-2-6-11(9)7-8/h1-6H,7,10H2
InChIKeyKXXUFNOMOFTRTO-UHFFFAOYSA-N
MW146.19 g/mol
LogP1.11
Rot. Bonds

About 4H-quinolizin-3-amine

4H-quinolizin-3-amine (PubChem CID 57421862) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is 4H-quinolizin-3-amine.

Molecular Properties

Compound Name4H-quinolizin-3-amine
PubChem CID57421862
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name4H-quinolizin-3-amine
SMILESNC1=CC=C2C=CC=CN2C1
InChIInChI=1S/C9H10N2/c10-8-4-5-9-3-1-2-6-11(9)7-8/h1-6H,7,10H2
InChIKeyKXXUFNOMOFTRTO-UHFFFAOYSA-N
XLogP1.11
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4H-quinolizin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4H-quinolizin-3-amine?
The IUPAC name of 4H-quinolizin-3-amine (CID 57421862) is 4H-quinolizin-3-amine.
What is the SMILES notation for 4H-quinolizin-3-amine?
The canonical SMILES for 4H-quinolizin-3-amine is NC1=CC=C2C=CC=CN2C1.
What is the InChIKey of 4H-quinolizin-3-amine?
The InChIKey is KXXUFNOMOFTRTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2/c10-8-4-5-9-3-1-2-6-11(9)7-8/h1-6H,7,10H2.
What are the key properties of 4H-quinolizin-3-amine?
4H-quinolizin-3-amine has a molecular weight of 146.19 g/mol, XLogP of 1.11, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4H-quinolizin-3-amine is sourced from PubChem (CID 57421862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).