(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol

C18H16FNO — CID 115826569

IUPAC(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol
SMILESCc1ccc(C(O)c2ccc3nc(C)ccc3c2)c(F)c1
InChIInChI=1S/C18H16FNO/c1-11-3-7-15(16(19)9-11)18(21)14-6-8-17-13(10-14)5-4-12(2)20-17/h3-10,18,21H,1-2H3
InChIKeyOPUQNVVCXLVJNQ-UHFFFAOYSA-N
MW281.33 g/mol
LogP4.07
Rot. Bonds2

About (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol

(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol (PubChem CID 115826569) has the molecular formula C18H16FNO and a molecular weight of 281.33 g/mol. Its IUPAC name is (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol.

Molecular Properties

Compound Name(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol
PubChem CID115826569
Molecular FormulaC18H16FNO
Molecular Weight281.33 g/mol
Exact Mass281.12
IUPAC Name(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol
SMILESCc1ccc(C(O)c2ccc3nc(C)ccc3c2)c(F)c1
InChIInChI=1S/C18H16FNO/c1-11-3-7-15(16(19)9-11)18(21)14-6-8-17-13(10-14)5-4-12(2)20-17/h3-10,18,21H,1-2H3
InChIKeyOPUQNVVCXLVJNQ-UHFFFAOYSA-N
XLogP4.07
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluoro-4-methylphenyl)-naphthalen-2-ylmethanol
CID 115792718
(2-bromo-5-fluorophenyl)-(2-methylquinolin-6-yl)methanol
CID 115826640
(2-fluoro-4-methylphenyl)-pyridin-4-ylmethanol
CID 23294400
(1,5-dimethylpyrazol-4-yl)-(2-methylquinolin-6-yl)methanol
CID 81215608
1-(2-methylquinolin-6-yl)butane-1,2,4-triol
CID 171873072
(4-amino-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105379142
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(2-methylquinolin-6-yl)-thiophen-2-ylmethanol
CID 81215895
(2-methylquinolin-6-yl)-pyridazin-4-ylmethanol
CID 105118439
(2-methoxy-3-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105118483
(3-methoxy-4-pyridinyl)-(2-methylquinolin-6-yl)methanol
CID 105066395
1-(2-methylquinolin-6-yl)propan-1-ol
CID 81216711

Frequently Asked Questions

What is the IUPAC name of (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol?
The IUPAC name of (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol (CID 115826569) is (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol.
What is the SMILES notation for (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol?
The canonical SMILES for (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol is Cc1ccc(C(O)c2ccc3nc(C)ccc3c2)c(F)c1.
What is the InChIKey of (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol?
The InChIKey is OPUQNVVCXLVJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO/c1-11-3-7-15(16(19)9-11)18(21)14-6-8-17-13(10-14)5-4-12(2)20-17/h3-10,18,21H,1-2H3.
What are the key properties of (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol?
(2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol has a molecular weight of 281.33 g/mol, XLogP of 4.07, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-fluoro-4-methylphenyl)-(2-methylquinolin-6-yl)methanol is sourced from PubChem (CID 115826569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).