1-phenyl-5H-pyrido[4,3-b]indol-4-ol

C17H12N2O — CID 10967238

IUPAC1-phenyl-5H-pyrido[4,3-b]indol-4-ol
SMILESOc1cnc(-c2ccccc2)c2c1[nH]c1ccccc12
InChIInChI=1S/C17H12N2O/c20-14-10-18-16(11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)19-17(14)15/h1-10,19-20H
InChIKeyJAOGACONLGYOHL-UHFFFAOYSA-N
MW260.30 g/mol
LogP4.09
Rot. Bonds1

About 1-phenyl-5H-pyrido[4,3-b]indol-4-ol

1-phenyl-5H-pyrido[4,3-b]indol-4-ol (PubChem CID 10967238) has the molecular formula C17H12N2O and a molecular weight of 260.30 g/mol. Its IUPAC name is 1-phenyl-5H-pyrido[4,3-b]indol-4-ol.

Molecular Properties

Compound Name1-phenyl-5H-pyrido[4,3-b]indol-4-ol
PubChem CID10967238
Molecular FormulaC17H12N2O
Molecular Weight260.30 g/mol
Exact Mass260.09
IUPAC Name1-phenyl-5H-pyrido[4,3-b]indol-4-ol
SMILESOc1cnc(-c2ccccc2)c2c1[nH]c1ccccc12
InChIInChI=1S/C17H12N2O/c20-14-10-18-16(11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)19-17(14)15/h1-10,19-20H
InChIKeyJAOGACONLGYOHL-UHFFFAOYSA-N
XLogP4.09
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.30
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-phenyl-5H-pyrido[4,3-b]indol-4-ol?
The IUPAC name of 1-phenyl-5H-pyrido[4,3-b]indol-4-ol (CID 10967238) is 1-phenyl-5H-pyrido[4,3-b]indol-4-ol.
What is the SMILES notation for 1-phenyl-5H-pyrido[4,3-b]indol-4-ol?
The canonical SMILES for 1-phenyl-5H-pyrido[4,3-b]indol-4-ol is Oc1cnc(-c2ccccc2)c2c1[nH]c1ccccc12.
What is the InChIKey of 1-phenyl-5H-pyrido[4,3-b]indol-4-ol?
The InChIKey is JAOGACONLGYOHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12N2O/c20-14-10-18-16(11-6-2-1-3-7-11)15-12-8-4-5-9-13(12)19-17(14)15/h1-10,19-20H.
What are the key properties of 1-phenyl-5H-pyrido[4,3-b]indol-4-ol?
1-phenyl-5H-pyrido[4,3-b]indol-4-ol has a molecular weight of 260.30 g/mol, XLogP of 4.09, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-5H-pyrido[4,3-b]indol-4-ol is sourced from PubChem (CID 10967238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).