2,7,8,9-tetrahydrobenzo[f]quinoline

C13H13N — CID 90915036

IUPAC2,7,8,9-tetrahydrobenzo[f]quinoline
SMILESC1=Nc2ccc3c(c2=CC1)=CCCC3
InChIInChI=1S/C13H13N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h5-9H,1-4H2
InChIKeyGQXHDHURQUHSIB-UHFFFAOYSA-N
MW183.25 g/mol
LogP1.69
Rot. Bonds

About 2,7,8,9-tetrahydrobenzo[f]quinoline

2,7,8,9-tetrahydrobenzo[f]quinoline (PubChem CID 90915036) has the molecular formula C13H13N and a molecular weight of 183.25 g/mol. Its IUPAC name is 2,7,8,9-tetrahydrobenzo[f]quinoline.

Molecular Properties

Compound Name2,7,8,9-tetrahydrobenzo[f]quinoline
PubChem CID90915036
Molecular FormulaC13H13N
Molecular Weight183.25 g/mol
Exact Mass183.10
IUPAC Name2,7,8,9-tetrahydrobenzo[f]quinoline
SMILESC1=Nc2ccc3c(c2=CC1)=CCCC3
InChIInChI=1S/C13H13N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h5-9H,1-4H2
InChIKeyGQXHDHURQUHSIB-UHFFFAOYSA-N
XLogP1.69
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3,4,5,6-Tetrahydroquinoline
CID 54214651
Dihydrodibenzazepine
CID 87126010
4,5-Dihydroindenopyridine
CID 129783754
8,13,17-Triazatetracyclo[8.7.0.02,7.011,16]heptadeca-1(17),2(7),8,10,13,15-hexaene
CID 67854465
8,11,15-Triazatetracyclo[8.7.0.02,7.012,17]heptadeca-1(17),2(7),8,10,12,14-hexaene
CID 70413588
(5Z,6E)-6-ethylidene-5-prop-2-enylidene-3,4-dihydropyridine
CID 89200020
4,5-Dimethyl-6,7-dihydroquinoline
CID 89495206
3,4,6,7-Tetrahydroquinoline
CID 91192800
6,7,8,9-tetrahydro-3H-1-benzazepine
CID 91238174
3,4,6,7,8,8a-Hexahydroquinoline
CID 91429706
(6E)-6-[(Z)-but-2-enylidene]-5-methylidene-3,4-dihydropyridine
CID 117906908
6-Cyclohexa-1,3-dien-1-yl-3,4-dihydropyridine
CID 123137253

Frequently Asked Questions

What is the IUPAC name of 2,7,8,9-tetrahydrobenzo[f]quinoline?
The IUPAC name of 2,7,8,9-tetrahydrobenzo[f]quinoline (CID 90915036) is 2,7,8,9-tetrahydrobenzo[f]quinoline.
What is the SMILES notation for 2,7,8,9-tetrahydrobenzo[f]quinoline?
The canonical SMILES for 2,7,8,9-tetrahydrobenzo[f]quinoline is C1=Nc2ccc3c(c2=CC1)=CCCC3.
What is the InChIKey of 2,7,8,9-tetrahydrobenzo[f]quinoline?
The InChIKey is GQXHDHURQUHSIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h5-9H,1-4H2.
What are the key properties of 2,7,8,9-tetrahydrobenzo[f]quinoline?
2,7,8,9-tetrahydrobenzo[f]quinoline has a molecular weight of 183.25 g/mol, XLogP of 1.69, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7,8,9-tetrahydrobenzo[f]quinoline is sourced from PubChem (CID 90915036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).