7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol

C13H12N2O — CID 25113696

IUPAC7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol
SMILESCc1cc2[nH]c3cccnc3c2c(C)c1O
InChIInChI=1S/C13H12N2O/c1-7-6-10-11(8(2)13(7)16)12-9(15-10)4-3-5-14-12/h3-6,15-16H,1-2H3
InChIKeyISLNUDFCPIKSRK-UHFFFAOYSA-N
MW212.25 g/mol
LogP3.04
Rot. Bonds

About 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol

7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol (PubChem CID 25113696) has the molecular formula C13H12N2O and a molecular weight of 212.25 g/mol. Its IUPAC name is 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol.

Molecular Properties

Compound Name7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol
PubChem CID25113696
Molecular FormulaC13H12N2O
Molecular Weight212.25 g/mol
Exact Mass212.09
IUPAC Name7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol
SMILESCc1cc2[nH]c3cccnc3c2c(C)c1O
InChIInChI=1S/C13H12N2O/c1-7-6-10-11(8(2)13(7)16)12-9(15-10)4-3-5-14-12/h3-6,15-16H,1-2H3
InChIKeyISLNUDFCPIKSRK-UHFFFAOYSA-N
XLogP3.04
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol?
The IUPAC name of 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol (CID 25113696) is 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol.
What is the SMILES notation for 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol?
The canonical SMILES for 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol is Cc1cc2[nH]c3cccnc3c2c(C)c1O.
What is the InChIKey of 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol?
The InChIKey is ISLNUDFCPIKSRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O/c1-7-6-10-11(8(2)13(7)16)12-9(15-10)4-3-5-14-12/h3-6,15-16H,1-2H3.
What are the key properties of 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol?
7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol has a molecular weight of 212.25 g/mol, XLogP of 3.04, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,9-dimethyl-5H-pyrido[3,2-b]indol-8-ol is sourced from PubChem (CID 25113696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).