5,7,9-trimethylpyrido[3,2-b]indol-8-ol

C14H14N2O — CID 44567454

IUPAC5,7,9-trimethylpyrido[3,2-b]indol-8-ol
SMILESCc1cc2c(c(C)c1O)c1ncccc1n2C
InChIInChI=1S/C14H14N2O/c1-8-7-11-12(9(2)14(8)17)13-10(16(11)3)5-4-6-15-13/h4-7,17H,1-3H3
InChIKeyHGIQNBUVVTWBSJ-UHFFFAOYSA-N
MW226.28 g/mol
LogP3.05
Rot. Bonds

About 5,7,9-trimethylpyrido[3,2-b]indol-8-ol

5,7,9-trimethylpyrido[3,2-b]indol-8-ol (PubChem CID 44567454) has the molecular formula C14H14N2O and a molecular weight of 226.28 g/mol. Its IUPAC name is 5,7,9-trimethylpyrido[3,2-b]indol-8-ol.

Molecular Properties

Compound Name5,7,9-trimethylpyrido[3,2-b]indol-8-ol
PubChem CID44567454
Molecular FormulaC14H14N2O
Molecular Weight226.28 g/mol
Exact Mass226.11
IUPAC Name5,7,9-trimethylpyrido[3,2-b]indol-8-ol
SMILESCc1cc2c(c(C)c1O)c1ncccc1n2C
InChIInChI=1S/C14H14N2O/c1-8-7-11-12(9(2)14(8)17)13-10(16(11)3)5-4-6-15-13/h4-7,17H,1-3H3
InChIKeyHGIQNBUVVTWBSJ-UHFFFAOYSA-N
XLogP3.05
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,7,9-trimethylpyrido[3,2-b]indol-8-ol?
The IUPAC name of 5,7,9-trimethylpyrido[3,2-b]indol-8-ol (CID 44567454) is 5,7,9-trimethylpyrido[3,2-b]indol-8-ol.
What is the SMILES notation for 5,7,9-trimethylpyrido[3,2-b]indol-8-ol?
The canonical SMILES for 5,7,9-trimethylpyrido[3,2-b]indol-8-ol is Cc1cc2c(c(C)c1O)c1ncccc1n2C.
What is the InChIKey of 5,7,9-trimethylpyrido[3,2-b]indol-8-ol?
The InChIKey is HGIQNBUVVTWBSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O/c1-8-7-11-12(9(2)14(8)17)13-10(16(11)3)5-4-6-15-13/h4-7,17H,1-3H3.
What are the key properties of 5,7,9-trimethylpyrido[3,2-b]indol-8-ol?
5,7,9-trimethylpyrido[3,2-b]indol-8-ol has a molecular weight of 226.28 g/mol, XLogP of 3.05, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7,9-trimethylpyrido[3,2-b]indol-8-ol is sourced from PubChem (CID 44567454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).