9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline

C19H16FN — CID 134913901

IUPAC9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline
SMILESFc1ccc2nc3c(c(Cc4ccccc4)c2c1)CCC3
InChIInChI=1S/C19H16FN/c20-14-9-10-19-17(12-14)16(11-13-5-2-1-3-6-13)15-7-4-8-18(15)21-19/h1-3,5-6,9-10,12H,4,7-8,11H2
InChIKeyZQCCOTUITOWMRB-UHFFFAOYSA-N
MW277.34 g/mol
LogP4.45
Rot. Bonds2

About 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline

9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline (PubChem CID 134913901) has the molecular formula C19H16FN and a molecular weight of 277.34 g/mol. Its IUPAC name is 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline.

Molecular Properties

Compound Name9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline
PubChem CID134913901
Molecular FormulaC19H16FN
Molecular Weight277.34 g/mol
Exact Mass277.13
IUPAC Name9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline
SMILESFc1ccc2nc3c(c(Cc4ccccc4)c2c1)CCC3
InChIInChI=1S/C19H16FN/c20-14-9-10-19-17(12-14)16(11-13-5-2-1-3-6-13)15-7-4-8-18(15)21-19/h1-3,5-6,9-10,12H,4,7-8,11H2
InChIKeyZQCCOTUITOWMRB-UHFFFAOYSA-N
XLogP4.45
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.34
LogP ≤ 54.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

(7-fluoro-1,2,3,4-tetrahydroacridin-9-yl)methanamine
CID 82451478
2-(7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)acetic acid
CID 82451440
N-benzyl-7-fluoro-1,2,3,4-tetrahydroacridin-9-amine
CID 175457647
N-[(7-fluoro-1,2,3,4-tetrahydroacridin-9-yl)methyl]propan-2-amine
CID 82451463
7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid
CID 865221
9-(bromomethyl)-2,3-dihydro-1H-cyclopenta[b]quinoline
CID 82449852
2-(7-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)acetonitrile
CID 82450438
7-decyl-9-[(4-methoxyphenyl)methyl]-1,2,3,4-tetrahydroacridine
CID 22367590
N-butan-2-yl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxamide
CID 53016227
4-(7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-1,3-thiazol-2-amine
CID 82451450
6-fluoro-N-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
CID 103996137
(7-chloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)methanethiol
CID 82451346

Frequently Asked Questions

What is the IUPAC name of 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline?
The IUPAC name of 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline (CID 134913901) is 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline.
What is the SMILES notation for 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline?
The canonical SMILES for 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline is Fc1ccc2nc3c(c(Cc4ccccc4)c2c1)CCC3.
What is the InChIKey of 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline?
The InChIKey is ZQCCOTUITOWMRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN/c20-14-9-10-19-17(12-14)16(11-13-5-2-1-3-6-13)15-7-4-8-18(15)21-19/h1-3,5-6,9-10,12H,4,7-8,11H2.
What are the key properties of 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline?
9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline has a molecular weight of 277.34 g/mol, XLogP of 4.45, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-benzyl-7-fluoro-2,3-dihydro-1H-cyclopenta[b]quinoline is sourced from PubChem (CID 134913901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).