2-prop-2-enyl-1H-quinolin-2-ol

C12H13NO — CID 138562651

IUPAC2-prop-2-enyl-1H-quinolin-2-ol
SMILESC=CCC1(O)C=Cc2ccccc2N1
InChIInChI=1S/C12H13NO/c1-2-8-12(14)9-7-10-5-3-4-6-11(10)13-12/h2-7,9,13-14H,1,8H2
InChIKeyXONRTCWBUOCAIN-UHFFFAOYSA-N
MW187.24 g/mol
LogP2.39
Rot. Bonds2

About 2-prop-2-enyl-1H-quinolin-2-ol

2-prop-2-enyl-1H-quinolin-2-ol (PubChem CID 138562651) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-prop-2-enyl-1H-quinolin-2-ol.

Molecular Properties

Compound Name2-prop-2-enyl-1H-quinolin-2-ol
PubChem CID138562651
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name2-prop-2-enyl-1H-quinolin-2-ol
SMILESC=CCC1(O)C=Cc2ccccc2N1
InChIInChI=1S/C12H13NO/c1-2-8-12(14)9-7-10-5-3-4-6-11(10)13-12/h2-7,9,13-14H,1,8H2
InChIKeyXONRTCWBUOCAIN-UHFFFAOYSA-N
XLogP2.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-prop-2-enyl-1H-quinolin-2-ol?
The IUPAC name of 2-prop-2-enyl-1H-quinolin-2-ol (CID 138562651) is 2-prop-2-enyl-1H-quinolin-2-ol.
What is the SMILES notation for 2-prop-2-enyl-1H-quinolin-2-ol?
The canonical SMILES for 2-prop-2-enyl-1H-quinolin-2-ol is C=CCC1(O)C=Cc2ccccc2N1.
What is the InChIKey of 2-prop-2-enyl-1H-quinolin-2-ol?
The InChIKey is XONRTCWBUOCAIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-2-8-12(14)9-7-10-5-3-4-6-11(10)13-12/h2-7,9,13-14H,1,8H2.
What are the key properties of 2-prop-2-enyl-1H-quinolin-2-ol?
2-prop-2-enyl-1H-quinolin-2-ol has a molecular weight of 187.24 g/mol, XLogP of 2.39, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-prop-2-enyl-1H-quinolin-2-ol is sourced from PubChem (CID 138562651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).