(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol

C18H16FNO — CID 79233806

IUPAC(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol
SMILESCc1cc(C(O)c2ccc(F)c(C)c2)c2ccccc2n1
InChIInChI=1S/C18H16FNO/c1-11-9-13(7-8-16(11)19)18(21)15-10-12(2)20-17-6-4-3-5-14(15)17/h3-10,18,21H,1-2H3
InChIKeyRIWPIQNBTXRFHQ-UHFFFAOYSA-N
MW281.33 g/mol
LogP4.07
Rot. Bonds2

About (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol

(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol (PubChem CID 79233806) has the molecular formula C18H16FNO and a molecular weight of 281.33 g/mol. Its IUPAC name is (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol.

Molecular Properties

Compound Name(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol
PubChem CID79233806
Molecular FormulaC18H16FNO
Molecular Weight281.33 g/mol
Exact Mass281.12
IUPAC Name(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol
SMILESCc1cc(C(O)c2ccc(F)c(C)c2)c2ccccc2n1
InChIInChI=1S/C18H16FNO/c1-11-9-13(7-8-16(11)19)18(21)15-10-12(2)20-17-6-4-3-5-14(15)17/h3-10,18,21H,1-2H3
InChIKeyRIWPIQNBTXRFHQ-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

(4-chlorophenyl)-(2-methylquinolin-4-yl)methanol
CID 79234879
(3,4-difluorophenyl)-(4-methylquinolin-2-yl)methanol
CID 114754840
(5-chloro-2-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 79747556
1-(4-chlorophenyl)-N-methyl-1-(2-methylquinolin-4-yl)methanamine
CID 105076264
(4-fluoro-3-methylphenyl)-(2-methoxyphenyl)methanol
CID 60929843
(2-chloro-4,5-dimethylphenyl)-(4-fluoro-3-methylphenyl)methanol
CID 115484419
(4-fluoro-3-methylphenyl)-[2-(trifluoromethyl)phenyl]methanol
CID 62801811
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
(2-chloro-4-fluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 55152989
(4-fluoro-3-methylphenyl)-(3-methyl-2-pyridinyl)methanol
CID 62789628
(3-chloro-2-pyridinyl)-(4-fluoro-3-methylphenyl)methanol
CID 103443403
(3,5-dichlorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 63899311

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol?
The IUPAC name of (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol (CID 79233806) is (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol.
What is the SMILES notation for (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol?
The canonical SMILES for (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol is Cc1cc(C(O)c2ccc(F)c(C)c2)c2ccccc2n1.
What is the InChIKey of (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol?
The InChIKey is RIWPIQNBTXRFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FNO/c1-11-9-13(7-8-16(11)19)18(21)15-10-12(2)20-17-6-4-3-5-14(15)17/h3-10,18,21H,1-2H3.
What are the key properties of (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol?
(4-fluoro-3-methylphenyl)-(2-methylquinolin-4-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 (4-fluoro-3-methylphenyl)-(2-methylquinolin-4-yl)methanol is sourced from PubChem (CID 79233806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).