2-hydroxy-3,4-dihydropyrido[3,4-b]indole

C11H10N2O — CID 14060368

IUPAC2-hydroxy-3,4-dihydropyrido[3,4-b]indole
SMILESON1C=C2N=c3ccccc3=C2CC1
InChIInChI=1S/C11H10N2O/c14-13-6-5-9-8-3-1-2-4-10(8)12-11(9)7-13/h1-4,7,14H,5-6H2
InChIKeyFAJGQFVVBIDJHX-UHFFFAOYSA-N
MW186.21 g/mol
LogP0.41
Rot. Bonds

About 2-hydroxy-3,4-dihydropyrido[3,4-b]indole

2-hydroxy-3,4-dihydropyrido[3,4-b]indole (PubChem CID 14060368) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 2-hydroxy-3,4-dihydropyrido[3,4-b]indole.

Molecular Properties

Compound Name2-hydroxy-3,4-dihydropyrido[3,4-b]indole
PubChem CID14060368
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name2-hydroxy-3,4-dihydropyrido[3,4-b]indole
SMILESON1C=C2N=c3ccccc3=C2CC1
InChIInChI=1S/C11H10N2O/c14-13-6-5-9-8-3-1-2-4-10(8)12-11(9)7-13/h1-4,7,14H,5-6H2
InChIKeyFAJGQFVVBIDJHX-UHFFFAOYSA-N
XLogP0.41
TPSA35.83 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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N-vinyl-1,2,5-oxadiazolo[3,4-g]indole
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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-3,4-dihydropyrido[3,4-b]indole?
The IUPAC name of 2-hydroxy-3,4-dihydropyrido[3,4-b]indole (CID 14060368) is 2-hydroxy-3,4-dihydropyrido[3,4-b]indole.
What is the SMILES notation for 2-hydroxy-3,4-dihydropyrido[3,4-b]indole?
The canonical SMILES for 2-hydroxy-3,4-dihydropyrido[3,4-b]indole is ON1C=C2N=c3ccccc3=C2CC1.
What is the InChIKey of 2-hydroxy-3,4-dihydropyrido[3,4-b]indole?
The InChIKey is FAJGQFVVBIDJHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-13-6-5-9-8-3-1-2-4-10(8)12-11(9)7-13/h1-4,7,14H,5-6H2.
What are the key properties of 2-hydroxy-3,4-dihydropyrido[3,4-b]indole?
2-hydroxy-3,4-dihydropyrido[3,4-b]indole has a molecular weight of 186.21 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-3,4-dihydropyrido[3,4-b]indole is sourced from PubChem (CID 14060368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).