1-ethenyl-9H-pyrido[3,4-b]indol-8-ol

C13H10N2O — CID 5353368

IUPAC1-ethenyl-9H-pyrido[3,4-b]indol-8-ol
SMILESC=Cc1nccc2c1[nH]c1c(O)cccc12
InChIInChI=1S/C13H10N2O/c1-2-10-12-9(6-7-14-10)8-4-3-5-11(16)13(8)15-12/h2-7,15-16H,1H2
InChIKeyRZWQZVWQFRVQCI-UHFFFAOYSA-N
MW210.24 g/mol
LogP3.06
Rot. Bonds1

About 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol

1-ethenyl-9H-pyrido[3,4-b]indol-8-ol (PubChem CID 5353368) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol.

Molecular Properties

Compound Name1-ethenyl-9H-pyrido[3,4-b]indol-8-ol
PubChem CID5353368
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name1-ethenyl-9H-pyrido[3,4-b]indol-8-ol
SMILESC=Cc1nccc2c1[nH]c1c(O)cccc12
InChIInChI=1S/C13H10N2O/c1-2-10-12-9(6-7-14-10)8-4-3-5-11(16)13(8)15-12/h2-7,15-16H,1H2
InChIKeyRZWQZVWQFRVQCI-UHFFFAOYSA-N
XLogP3.06
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol?
The IUPAC name of 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol (CID 5353368) is 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol.
What is the SMILES notation for 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol?
The canonical SMILES for 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol is C=Cc1nccc2c1[nH]c1c(O)cccc12.
What is the InChIKey of 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol?
The InChIKey is RZWQZVWQFRVQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c1-2-10-12-9(6-7-14-10)8-4-3-5-11(16)13(8)15-12/h2-7,15-16H,1H2.
What are the key properties of 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol?
1-ethenyl-9H-pyrido[3,4-b]indol-8-ol has a molecular weight of 210.24 g/mol, XLogP of 3.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-9H-pyrido[3,4-b]indol-8-ol is sourced from PubChem (CID 5353368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).