2-propan-2-ylquinolin-8-ol

C12H13NO — CID 4218732

IUPAC2-propan-2-ylquinolin-8-ol
SMILESCC(C)c1ccc2cccc(O)c2n1
InChIInChI=1S/C12H13NO/c1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10/h3-8,14H,1-2H3
InChIKeySROIKOWWTSXBCI-UHFFFAOYSA-N
MW187.24 g/mol
LogP3.06
Rot. Bonds1

About 2-propan-2-ylquinolin-8-ol

2-propan-2-ylquinolin-8-ol (PubChem CID 4218732) has the molecular formula C12H13NO and a molecular weight of 187.24 g/mol. Its IUPAC name is 2-propan-2-ylquinolin-8-ol.

Molecular Properties

Compound Name2-propan-2-ylquinolin-8-ol
PubChem CID4218732
Molecular FormulaC12H13NO
Molecular Weight187.24 g/mol
Exact Mass187.10
IUPAC Name2-propan-2-ylquinolin-8-ol
SMILESCC(C)c1ccc2cccc(O)c2n1
InChIInChI=1S/C12H13NO/c1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10/h3-8,14H,1-2H3
InChIKeySROIKOWWTSXBCI-UHFFFAOYSA-N
XLogP3.06
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.24
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-propan-2-ylquinolin-8-ol?
The IUPAC name of 2-propan-2-ylquinolin-8-ol (CID 4218732) is 2-propan-2-ylquinolin-8-ol.
What is the SMILES notation for 2-propan-2-ylquinolin-8-ol?
The canonical SMILES for 2-propan-2-ylquinolin-8-ol is CC(C)c1ccc2cccc(O)c2n1.
What is the InChIKey of 2-propan-2-ylquinolin-8-ol?
The InChIKey is SROIKOWWTSXBCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13NO/c1-8(2)10-7-6-9-4-3-5-11(14)12(9)13-10/h3-8,14H,1-2H3.
What are the key properties of 2-propan-2-ylquinolin-8-ol?
2-propan-2-ylquinolin-8-ol has a molecular weight of 187.24 g/mol, XLogP of 3.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-ylquinolin-8-ol is sourced from PubChem (CID 4218732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).