5,7,9-trimethylpyrido[2,3-b]indole

C14H14N2 — CID 20672284

IUPAC5,7,9-trimethylpyrido[2,3-b]indole
SMILESCc1cc(C)c2c3cccnc3n(C)c2c1
InChIInChI=1S/C14H14N2/c1-9-7-10(2)13-11-5-4-6-15-14(11)16(3)12(13)8-9/h4-8H,1-3H3
InChIKeyHQMSVKOYOIPWIT-UHFFFAOYSA-N
MW210.28 g/mol
LogP3.34
Rot. Bonds

About 5,7,9-trimethylpyrido[2,3-b]indole

5,7,9-trimethylpyrido[2,3-b]indole (PubChem CID 20672284) has the molecular formula C14H14N2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 5,7,9-trimethylpyrido[2,3-b]indole.

Molecular Properties

Compound Name5,7,9-trimethylpyrido[2,3-b]indole
PubChem CID20672284
Molecular FormulaC14H14N2
Molecular Weight210.28 g/mol
Exact Mass210.12
IUPAC Name5,7,9-trimethylpyrido[2,3-b]indole
SMILESCc1cc(C)c2c3cccnc3n(C)c2c1
InChIInChI=1S/C14H14N2/c1-9-7-10(2)13-11-5-4-6-15-14(11)16(3)12(13)8-9/h4-8H,1-3H3
InChIKeyHQMSVKOYOIPWIT-UHFFFAOYSA-N
XLogP3.34
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7,9-trimethylpyrido[2,3-b]indole?
The IUPAC name of 5,7,9-trimethylpyrido[2,3-b]indole (CID 20672284) is 5,7,9-trimethylpyrido[2,3-b]indole.
What is the SMILES notation for 5,7,9-trimethylpyrido[2,3-b]indole?
The canonical SMILES for 5,7,9-trimethylpyrido[2,3-b]indole is Cc1cc(C)c2c3cccnc3n(C)c2c1.
What is the InChIKey of 5,7,9-trimethylpyrido[2,3-b]indole?
The InChIKey is HQMSVKOYOIPWIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2/c1-9-7-10(2)13-11-5-4-6-15-14(11)16(3)12(13)8-9/h4-8H,1-3H3.
What are the key properties of 5,7,9-trimethylpyrido[2,3-b]indole?
5,7,9-trimethylpyrido[2,3-b]indole has a molecular weight of 210.28 g/mol, XLogP of 3.34, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7,9-trimethylpyrido[2,3-b]indole is sourced from PubChem (CID 20672284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).