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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Related Compounds

2,4,9-trimethylcarbazole
CID 12613661
9-methylpyrido[2,3-b]indole
CID 12596580
6-bromo-9-methylpyrido[2,3-b]indole
CID 19439810
ethane;9-methylpyrido[2,3-b]indole;propane
CID 171072564
1,2-dimethylpyrrolo[2,3-b]pyridin-3-amine
CID 82415409
2-[(3E)-hexa-1,3,5-trien-3-yl]-1,3-dimethylpyrrolo[2,3-b]pyridine
CID 143631634
ethane;2-[(3E)-hexa-1,3,5-trien-3-yl]-1,3-dimethylpyrrolo[2,3-b]pyridine
CID 143631633
23-methyl-18,20-diazaheptacyclo[18.10.1.02,7.08,13.014,19.021,26.027,31]hentriaconta-1(31),2,4,6,8,10,12,14(19),15,17,21(26),22,24,27,29-pentadecaene
CID 170187674
7-methyl-9-phenylpyrido[2,3-b]indole
CID 140770345
3-chloro-1-methyl-2-phenylpyrrolo[2,3-b]pyridine
CID 146162317
4-hydroxy-1,3-dimethyl-1,8-naphthyridin-2-one
CID 54702806
2-bromo-1,3,4,6-tetramethylindole
CID 84634563

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).