6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline

C13H16FN — CID 143910995

IUPAC6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline
SMILESCCC1C=c2ccc(C(C)F)nc2=CC1
InChIInChI=1S/C13H16FN/c1-3-10-4-6-13-11(8-10)5-7-12(15-13)9(2)14/h5-10H,3-4H2,1-2H3
InChIKeyAUEYTSAGQONZGH-UHFFFAOYSA-N
MW205.28 g/mol
LogP2.10
Rot. Bonds2

About 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline

6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline (PubChem CID 143910995) has the molecular formula C13H16FN and a molecular weight of 205.28 g/mol. Its IUPAC name is 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline.

Molecular Properties

Compound Name6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline
PubChem CID143910995
Molecular FormulaC13H16FN
Molecular Weight205.28 g/mol
Exact Mass205.13
IUPAC Name6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline
SMILESCCC1C=c2ccc(C(C)F)nc2=CC1
InChIInChI=1S/C13H16FN/c1-3-10-4-6-13-11(8-10)5-7-12(15-13)9(2)14/h5-10H,3-4H2,1-2H3
InChIKeyAUEYTSAGQONZGH-UHFFFAOYSA-N
XLogP2.10
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.28
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

6-fluoro-2,8a-dimethyl-8H-quinoline
CID 130413123
6-Fluoro-2,4,5-trimethyl-4a,5-dihydroquinoline
CID 137417507
6-Ethyl-2-(2,2,2-trifluoroethyl)-6,7-dihydroquinoline
CID 143910935
2-Methyl-6-(trifluoromethyl)-4,4a-dihydroquinoline
CID 164090413
3-Fluoro-1-methyl-4a,8a-dihydroisoquinoline
CID 143939495
(E)-4-(4-fluorocyclohexa-2,4-dien-1-yl)-N-prop-1-en-2-ylbut-3-en-2-imine
CID 156880573
(5E,7Z)-N-[(Z)-but-2-en-2-yl]-7-ethyl-5-fluoro-3-methylnona-5,7-dien-4-imine
CID 177041311
2-methyl-9bH-benzo[de]quinoline
CID 58939804
(2E,3Z)-2,3-di(ethylidene)quinoline
CID 59760794
2-Ethyl-4-methyl-4,4a-dihydroquinoline
CID 66608600
N-(6-methylcyclohexa-1,3-dien-1-yl)-6-methylidenecyclohex-2-en-1-imine
CID 68004378
2,3-Di(ethylidene)quinoline
CID 72554674

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline?
The IUPAC name of 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline (CID 143910995) is 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline.
What is the SMILES notation for 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline?
The canonical SMILES for 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline is CCC1C=c2ccc(C(C)F)nc2=CC1.
What is the InChIKey of 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline?
The InChIKey is AUEYTSAGQONZGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FN/c1-3-10-4-6-13-11(8-10)5-7-12(15-13)9(2)14/h5-10H,3-4H2,1-2H3.
What are the key properties of 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline?
6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline has a molecular weight of 205.28 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-2-(1-fluoroethyl)-6,7-dihydroquinoline is sourced from PubChem (CID 143910995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).