(4-methylphenyl)-quinolin-3-ylmethanol

C17H15NO — CID 60924632

IUPAC(4-methylphenyl)-quinolin-3-ylmethanol
SMILESCc1ccc(C(O)c2cnc3ccccc3c2)cc1
InChIInChI=1S/C17H15NO/c1-12-6-8-13(9-7-12)17(19)15-10-14-4-2-3-5-16(14)18-11-15/h2-11,17,19H,1H3
InChIKeyXZLDSXYTOCEUJR-UHFFFAOYSA-N
MW249.31 g/mol
LogP3.62
Rot. Bonds2

About (4-methylphenyl)-quinolin-3-ylmethanol

(4-methylphenyl)-quinolin-3-ylmethanol (PubChem CID 60924632) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is (4-methylphenyl)-quinolin-3-ylmethanol.

Molecular Properties

Compound Name(4-methylphenyl)-quinolin-3-ylmethanol
PubChem CID60924632
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name(4-methylphenyl)-quinolin-3-ylmethanol
SMILESCc1ccc(C(O)c2cnc3ccccc3c2)cc1
InChIInChI=1S/C17H15NO/c1-12-6-8-13(9-7-12)17(19)15-10-14-4-2-3-5-16(14)18-11-15/h2-11,17,19H,1H3
InChIKeyXZLDSXYTOCEUJR-UHFFFAOYSA-N
XLogP3.62
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4-chlorophenyl)-quinolin-3-ylmethanol
CID 20794845
(2,4-dimethylphenyl)-quinolin-3-ylmethanol
CID 63894313
(4-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893046
(4-cyclopropylphenyl)-quinolin-3-ylmethanol
CID 79971514
(5-methylpyrazin-2-yl)-quinolin-3-ylmethanol
CID 105079360
N-[(4-methylphenyl)-quinolin-3-ylmethyl]ethanamine
CID 60923858
(3-methoxyphenyl)-quinolin-3-ylmethanol
CID 60924189
(2-ethoxyphenyl)-quinolin-3-ylmethanol
CID 63893818
fluoro(quinolin-3-yl)methanol
CID 163892772
2,2-dimethyl-1-quinolin-3-ylpropan-1-ol
CID 60924299
(2-chlorophenyl)-quinolin-3-ylmethanol
CID 62099090
(5-bromo-4-methylthiophen-2-yl)-quinolin-3-ylmethanol
CID 114979842

Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl)-quinolin-3-ylmethanol?
The IUPAC name of (4-methylphenyl)-quinolin-3-ylmethanol (CID 60924632) is (4-methylphenyl)-quinolin-3-ylmethanol.
What is the SMILES notation for (4-methylphenyl)-quinolin-3-ylmethanol?
The canonical SMILES for (4-methylphenyl)-quinolin-3-ylmethanol is Cc1ccc(C(O)c2cnc3ccccc3c2)cc1.
What is the InChIKey of (4-methylphenyl)-quinolin-3-ylmethanol?
The InChIKey is XZLDSXYTOCEUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-12-6-8-13(9-7-12)17(19)15-10-14-4-2-3-5-16(14)18-11-15/h2-11,17,19H,1H3.
What are the key properties of (4-methylphenyl)-quinolin-3-ylmethanol?
(4-methylphenyl)-quinolin-3-ylmethanol has a molecular weight of 249.31 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl)-quinolin-3-ylmethanol is sourced from PubChem (CID 60924632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).