[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol

C15H19NO2 — CID 63376065

IUPAC[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol
SMILESCCC(C)(C)Oc1cc(CO)nc2ccccc12
InChIInChI=1S/C15H19NO2/c1-4-15(2,3)18-14-9-11(10-17)16-13-8-6-5-7-12(13)14/h5-9,17H,4,10H2,1-3H3
InChIKeyCAKLGWLVHVEPLU-UHFFFAOYSA-N
MW245.32 g/mol
LogP3.29
Rot. Bonds4

About [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol

[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol (PubChem CID 63376065) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol.

Molecular Properties

Compound Name[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol
PubChem CID63376065
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol
SMILESCCC(C)(C)Oc1cc(CO)nc2ccccc12
InChIInChI=1S/C15H19NO2/c1-4-15(2,3)18-14-9-11(10-17)16-13-8-6-5-7-12(13)14/h5-9,17H,4,10H2,1-3H3
InChIKeyCAKLGWLVHVEPLU-UHFFFAOYSA-N
XLogP3.29
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol?
The IUPAC name of [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol (CID 63376065) is [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol.
What is the SMILES notation for [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol?
The canonical SMILES for [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol is CCC(C)(C)Oc1cc(CO)nc2ccccc12.
What is the InChIKey of [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol?
The InChIKey is CAKLGWLVHVEPLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-4-15(2,3)18-14-9-11(10-17)16-13-8-6-5-7-12(13)14/h5-9,17H,4,10H2,1-3H3.
What are the key properties of [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol?
[4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol has a molecular weight of 245.32 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-methylbutan-2-yloxy)quinolin-2-yl]methanol is sourced from PubChem (CID 63376065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).