9H-pyrido[4,3-b]indole

C11H8N2 — CID 15897929

IUPAC9H-pyrido[4,3-b]indole
SMILESC1=CCC2=c3cnccc3=NC2=C1
InChIInChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-2,4-7H,3H2
InChIKeyYCUGJPCEGXIQHV-UHFFFAOYSA-N
MW168.20 g/mol
LogP0.71
Rot. Bonds

About 9H-pyrido[4,3-b]indole

9H-pyrido[4,3-b]indole (PubChem CID 15897929) has the molecular formula C11H8N2 and a molecular weight of 168.20 g/mol. Its IUPAC name is 9H-pyrido[4,3-b]indole.

Molecular Properties

Compound Name9H-pyrido[4,3-b]indole
PubChem CID15897929
Molecular FormulaC11H8N2
Molecular Weight168.20 g/mol
Exact Mass168.07
IUPAC Name9H-pyrido[4,3-b]indole
SMILESC1=CCC2=c3cnccc3=NC2=C1
InChIInChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-2,4-7H,3H2
InChIKeyYCUGJPCEGXIQHV-UHFFFAOYSA-N
XLogP0.71
TPSA25.25 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 50.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 9H-pyrido[4,3-b]indole 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 9H-pyrido[4,3-b]indole?
The IUPAC name of 9H-pyrido[4,3-b]indole (CID 15897929) is 9H-pyrido[4,3-b]indole.
What is the SMILES notation for 9H-pyrido[4,3-b]indole?
The canonical SMILES for 9H-pyrido[4,3-b]indole is C1=CCC2=c3cnccc3=NC2=C1.
What is the InChIKey of 9H-pyrido[4,3-b]indole?
The InChIKey is YCUGJPCEGXIQHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2/c1-2-4-10-8(3-1)9-7-12-6-5-11(9)13-10/h1-2,4-7H,3H2.
What are the key properties of 9H-pyrido[4,3-b]indole?
9H-pyrido[4,3-b]indole has a molecular weight of 168.20 g/mol, XLogP of 0.71, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9H-pyrido[4,3-b]indole is sourced from PubChem (CID 15897929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).