(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol

C11H14FNO — CID 117193715

IUPAC(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol
SMILESCC1(CO)CCc2cccc(F)c2N1
InChIInChI=1S/C11H14FNO/c1-11(7-14)6-5-8-3-2-4-9(12)10(8)13-11/h2-4,13-14H,5-7H2,1H3
InChIKeyHQSJIDBQJIJQIJ-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.93
Rot. Bonds1

About (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol

(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol (PubChem CID 117193715) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol.

Molecular Properties

Compound Name(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol
PubChem CID117193715
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol
SMILESCC1(CO)CCc2cccc(F)c2N1
InChIInChI=1S/C11H14FNO/c1-11(7-14)6-5-8-3-2-4-9(12)10(8)13-11/h2-4,13-14H,5-7H2,1H3
InChIKeyHQSJIDBQJIJQIJ-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol?
The IUPAC name of (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol (CID 117193715) is (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol.
What is the SMILES notation for (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol?
The canonical SMILES for (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol is CC1(CO)CCc2cccc(F)c2N1.
What is the InChIKey of (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol?
The InChIKey is HQSJIDBQJIJQIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(7-14)6-5-8-3-2-4-9(12)10(8)13-11/h2-4,13-14H,5-7H2,1H3.
What are the key properties of (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol?
(8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol has a molecular weight of 195.24 g/mol, XLogP of 1.93, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (8-fluoro-2-methyl-3,4-dihydro-1H-quinolin-2-yl)methanol is sourced from PubChem (CID 117193715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).