10a,10b-dihydrobenzo[f]quinoline

C13H11N — CID 91482637

IUPAC10a,10b-dihydrobenzo[f]quinoline
SMILESC1=CC2=CC=C3N=CC=CC3C2C=C1
InChIInChI=1S/C13H11N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h1-9,11-12H
InChIKeyIBLCRRZXKZXWQU-UHFFFAOYSA-N
MW181.24 g/mol
LogP2.81
Rot. Bonds

About 10a,10b-dihydrobenzo[f]quinoline

10a,10b-dihydrobenzo[f]quinoline (PubChem CID 91482637) has the molecular formula C13H11N and a molecular weight of 181.24 g/mol. Its IUPAC name is 10a,10b-dihydrobenzo[f]quinoline.

Molecular Properties

Compound Name10a,10b-dihydrobenzo[f]quinoline
PubChem CID91482637
Molecular FormulaC13H11N
Molecular Weight181.24 g/mol
Exact Mass181.09
IUPAC Name10a,10b-dihydrobenzo[f]quinoline
SMILESC1=CC2=CC=C3N=CC=CC3C2C=C1
InChIInChI=1S/C13H11N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h1-9,11-12H
InChIKeyIBLCRRZXKZXWQU-UHFFFAOYSA-N
XLogP2.81
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 10a,10b-dihydrobenzo[f]quinoline?
The IUPAC name of 10a,10b-dihydrobenzo[f]quinoline (CID 91482637) is 10a,10b-dihydrobenzo[f]quinoline.
What is the SMILES notation for 10a,10b-dihydrobenzo[f]quinoline?
The canonical SMILES for 10a,10b-dihydrobenzo[f]quinoline is C1=CC2=CC=C3N=CC=CC3C2C=C1.
What is the InChIKey of 10a,10b-dihydrobenzo[f]quinoline?
The InChIKey is IBLCRRZXKZXWQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11N/c1-2-5-11-10(4-1)7-8-13-12(11)6-3-9-14-13/h1-9,11-12H.
What are the key properties of 10a,10b-dihydrobenzo[f]quinoline?
10a,10b-dihydrobenzo[f]quinoline has a molecular weight of 181.24 g/mol, XLogP of 2.81, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10a,10b-dihydrobenzo[f]quinoline is sourced from PubChem (CID 91482637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).