2-fluoro-3-(2-methylquinolin-5-yl)phenol

C16H12FNO — CID 166336768

IUPAC2-fluoro-3-(2-methylquinolin-5-yl)phenol
SMILESCc1ccc2c(-c3cccc(O)c3F)cccc2n1
InChIInChI=1S/C16H12FNO/c1-10-8-9-12-11(4-2-6-14(12)18-10)13-5-3-7-15(19)16(13)17/h2-9,19H,1H3
InChIKeyDSAJWARBQNQOQT-UHFFFAOYSA-N
MW253.28 g/mol
LogP4.05
Rot. Bonds1

About 2-fluoro-3-(2-methylquinolin-5-yl)phenol

2-fluoro-3-(2-methylquinolin-5-yl)phenol (PubChem CID 166336768) has the molecular formula C16H12FNO and a molecular weight of 253.28 g/mol. Its IUPAC name is 2-fluoro-3-(2-methylquinolin-5-yl)phenol.

Molecular Properties

Compound Name2-fluoro-3-(2-methylquinolin-5-yl)phenol
PubChem CID166336768
Molecular FormulaC16H12FNO
Molecular Weight253.28 g/mol
Exact Mass253.09
IUPAC Name2-fluoro-3-(2-methylquinolin-5-yl)phenol
SMILESCc1ccc2c(-c3cccc(O)c3F)cccc2n1
InChIInChI=1S/C16H12FNO/c1-10-8-9-12-11(4-2-6-14(12)18-10)13-5-3-7-15(19)16(13)17/h2-9,19H,1H3
InChIKeyDSAJWARBQNQOQT-UHFFFAOYSA-N
XLogP4.05
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.28
LogP ≤ 54.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methyl-8-hydroxyquinoline
CID 13224
Tan-67
CID 9950038
2-Methylquinolin-3-ol
CID 594394
2-Acridinol, 5,6,7,8-tetrahydro-9-amino-, dihydrate
CID 3077884
9-Amino-2-hydroxyacridine
CID 23520
2-[2-(2-Quinolinyl)ethenyl]phenol
CID 2864430
3-[(4Ar,12aS)-2-methyl-1,3,4,5,12,12a-hexahydropyrido[3,4-b]acridin-4a-yl]phenol
CID 9911115
7-(3-Methoxyphenyl)-2-methylquinoline
CID 44432660
2-(4-Hydroxyphenyl)-4-vinylquinolin-6-ol
CID 135409729
4-Ethyl-2-(4-hydroxyphenyl)quinolin-6-ol
CID 135430317
4-Ethynyl-2-(4-hydroxyphenyl)quinolin-6-ol
CID 135524856
2-(4-Hydroxy-phenyl)-quinolin-6-ol
CID 135987619

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-3-(2-methylquinolin-5-yl)phenol?
The IUPAC name of 2-fluoro-3-(2-methylquinolin-5-yl)phenol (CID 166336768) is 2-fluoro-3-(2-methylquinolin-5-yl)phenol.
What is the SMILES notation for 2-fluoro-3-(2-methylquinolin-5-yl)phenol?
The canonical SMILES for 2-fluoro-3-(2-methylquinolin-5-yl)phenol is Cc1ccc2c(-c3cccc(O)c3F)cccc2n1.
What is the InChIKey of 2-fluoro-3-(2-methylquinolin-5-yl)phenol?
The InChIKey is DSAJWARBQNQOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12FNO/c1-10-8-9-12-11(4-2-6-14(12)18-10)13-5-3-7-15(19)16(13)17/h2-9,19H,1H3.
What are the key properties of 2-fluoro-3-(2-methylquinolin-5-yl)phenol?
2-fluoro-3-(2-methylquinolin-5-yl)phenol has a molecular weight of 253.28 g/mol, XLogP of 4.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-3-(2-methylquinolin-5-yl)phenol is sourced from PubChem (CID 166336768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).