5-ethyl-9-methylpyrido[3,2-b]indole

C14H14N2 — CID 171509495

IUPAC5-ethyl-9-methylpyrido[3,2-b]indole
SMILESCCn1c2cccnc2c2c(C)cccc21
InChIInChI=1S/C14H14N2/c1-3-16-11-7-4-6-10(2)13(11)14-12(16)8-5-9-15-14/h4-9H,3H2,1-2H3
InChIKeyFSRZVGVDBPDZDN-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.52
Rot. Bonds1

About 5-ethyl-9-methylpyrido[3,2-b]indole

5-ethyl-9-methylpyrido[3,2-b]indole (PubChem CID 171509495) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5-ethyl-9-methylpyrido[3,2-b]indole.

Molecular Properties

Compound Name5-ethyl-9-methylpyrido[3,2-b]indole
PubChem CID171509495
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name5-ethyl-9-methylpyrido[3,2-b]indole
SMILESCCn1c2cccnc2c2c(C)cccc21
InChIInChI=1S/C14H14N2/c1-3-16-11-7-4-6-10(2)13(11)14-12(16)8-5-9-15-14/h4-9H,3H2,1-2H3
InChIKeyFSRZVGVDBPDZDN-UHFFFAOYSA-N
XLogP3.52
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-ethyl-9-methylpyrido[3,2-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 5-ethyl-9-methylpyrido[3,2-b]indole?
The IUPAC name of 5-ethyl-9-methylpyrido[3,2-b]indole (CID 171509495) is 5-ethyl-9-methylpyrido[3,2-b]indole.
What is the SMILES notation for 5-ethyl-9-methylpyrido[3,2-b]indole?
The canonical SMILES for 5-ethyl-9-methylpyrido[3,2-b]indole is CCn1c2cccnc2c2c(C)cccc21.
What is the InChIKey of 5-ethyl-9-methylpyrido[3,2-b]indole?
The InChIKey is FSRZVGVDBPDZDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-3-16-11-7-4-6-10(2)13(11)14-12(16)8-5-9-15-14/h4-9H,3H2,1-2H3.
What are the key properties of 5-ethyl-9-methylpyrido[3,2-b]indole?
5-ethyl-9-methylpyrido[3,2-b]indole has a molecular weight of 210.28 g/mol, XLogP of 3.52, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-9-methylpyrido[3,2-b]indole is sourced from PubChem (CID 171509495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).