2-methyl-3-quinolin-6-ylpentan-3-ol

C15H19NO — CID 81215889

IUPAC2-methyl-3-quinolin-6-ylpentan-3-ol
SMILESCCC(O)(c1ccc2ncccc2c1)C(C)C
InChIInChI=1S/C15H19NO/c1-4-15(17,11(2)3)13-7-8-14-12(10-13)6-5-9-16-14/h5-11,17H,4H2,1-3H3
InChIKeyVBQQYIZSZNVNCN-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.49
Rot. Bonds3

About 2-methyl-3-quinolin-6-ylpentan-3-ol

2-methyl-3-quinolin-6-ylpentan-3-ol (PubChem CID 81215889) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is 2-methyl-3-quinolin-6-ylpentan-3-ol.

Molecular Properties

Compound Name2-methyl-3-quinolin-6-ylpentan-3-ol
PubChem CID81215889
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC Name2-methyl-3-quinolin-6-ylpentan-3-ol
SMILESCCC(O)(c1ccc2ncccc2c1)C(C)C
InChIInChI=1S/C15H19NO/c1-4-15(17,11(2)3)13-7-8-14-12(10-13)6-5-9-16-14/h5-11,17H,4H2,1-3H3
InChIKeyVBQQYIZSZNVNCN-UHFFFAOYSA-N
XLogP3.49
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-methyl-3-quinolin-6-ylpentan-3-ol 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 2-methyl-3-quinolin-6-ylpentan-3-ol?
The IUPAC name of 2-methyl-3-quinolin-6-ylpentan-3-ol (CID 81215889) is 2-methyl-3-quinolin-6-ylpentan-3-ol.
What is the SMILES notation for 2-methyl-3-quinolin-6-ylpentan-3-ol?
The canonical SMILES for 2-methyl-3-quinolin-6-ylpentan-3-ol is CCC(O)(c1ccc2ncccc2c1)C(C)C.
What is the InChIKey of 2-methyl-3-quinolin-6-ylpentan-3-ol?
The InChIKey is VBQQYIZSZNVNCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-4-15(17,11(2)3)13-7-8-14-12(10-13)6-5-9-16-14/h5-11,17H,4H2,1-3H3.
What are the key properties of 2-methyl-3-quinolin-6-ylpentan-3-ol?
2-methyl-3-quinolin-6-ylpentan-3-ol has a molecular weight of 229.32 g/mol, XLogP of 3.49, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-quinolin-6-ylpentan-3-ol is sourced from PubChem (CID 81215889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).