2-(3-hydroxyprop-2-enyl)quinolin-8-ol

C12H11NO2 — CID 66837760

IUPAC2-(3-hydroxyprop-2-enyl)quinolin-8-ol
SMILESOC=CCc1ccc2cccc(O)c2n1
InChIInChI=1S/C12H11NO2/c14-8-2-4-10-7-6-9-3-1-5-11(15)12(9)13-10/h1-3,5-8,14-15H,4H2
InChIKeyNRVMCLMDWZZIGG-UHFFFAOYSA-N
MW201.22 g/mol
LogP2.55
Rot. Bonds2

About 2-(3-hydroxyprop-2-enyl)quinolin-8-ol

2-(3-hydroxyprop-2-enyl)quinolin-8-ol (PubChem CID 66837760) has the molecular formula C12H11NO2 and a molecular weight of 201.22 g/mol. Its IUPAC name is 2-(3-hydroxyprop-2-enyl)quinolin-8-ol.

Molecular Properties

Compound Name2-(3-hydroxyprop-2-enyl)quinolin-8-ol
PubChem CID66837760
Molecular FormulaC12H11NO2
Molecular Weight201.22 g/mol
Exact Mass201.08
IUPAC Name2-(3-hydroxyprop-2-enyl)quinolin-8-ol
SMILESOC=CCc1ccc2cccc(O)c2n1
InChIInChI=1S/C12H11NO2/c14-8-2-4-10-7-6-9-3-1-5-11(15)12(9)13-10/h1-3,5-8,14-15H,4H2
InChIKeyNRVMCLMDWZZIGG-UHFFFAOYSA-N
XLogP2.55
TPSA53.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyprop-2-enyl)quinolin-8-ol?
The IUPAC name of 2-(3-hydroxyprop-2-enyl)quinolin-8-ol (CID 66837760) is 2-(3-hydroxyprop-2-enyl)quinolin-8-ol.
What is the SMILES notation for 2-(3-hydroxyprop-2-enyl)quinolin-8-ol?
The canonical SMILES for 2-(3-hydroxyprop-2-enyl)quinolin-8-ol is OC=CCc1ccc2cccc(O)c2n1.
What is the InChIKey of 2-(3-hydroxyprop-2-enyl)quinolin-8-ol?
The InChIKey is NRVMCLMDWZZIGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO2/c14-8-2-4-10-7-6-9-3-1-5-11(15)12(9)13-10/h1-3,5-8,14-15H,4H2.
What are the key properties of 2-(3-hydroxyprop-2-enyl)quinolin-8-ol?
2-(3-hydroxyprop-2-enyl)quinolin-8-ol has a molecular weight of 201.22 g/mol, XLogP of 2.55, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyprop-2-enyl)quinolin-8-ol is sourced from PubChem (CID 66837760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).