8,9-dihydronaphtho[2,3-g]quinoline

C17H13N — CID 130290942

IUPAC8,9-dihydronaphtho[2,3-g]quinoline
SMILESC1=c2cc3cc4cccnc4cc3cc2=CCC1
InChIInChI=1S/C17H13N/c1-2-5-13-9-16-11-17-14(6-3-7-18-17)10-15(16)8-12(13)4-1/h3-11H,1-2H2
InChIKeyBTMHNVXGXWEZQD-UHFFFAOYSA-N
MW231.30 g/mol
LogP2.74
Rot. Bonds

About 8,9-dihydronaphtho[2,3-g]quinoline

8,9-dihydronaphtho[2,3-g]quinoline (PubChem CID 130290942) has the molecular formula C17H13N and a molecular weight of 231.30 g/mol. Its IUPAC name is 8,9-dihydronaphtho[2,3-g]quinoline.

Molecular Properties

Compound Name8,9-dihydronaphtho[2,3-g]quinoline
PubChem CID130290942
Molecular FormulaC17H13N
Molecular Weight231.30 g/mol
Exact Mass231.10
IUPAC Name8,9-dihydronaphtho[2,3-g]quinoline
SMILESC1=c2cc3cc4cccnc4cc3cc2=CCC1
InChIInChI=1S/C17H13N/c1-2-5-13-9-16-11-17-14(6-3-7-18-17)10-15(16)8-12(13)4-1/h3-11H,1-2H2
InChIKeyBTMHNVXGXWEZQD-UHFFFAOYSA-N
XLogP2.74
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.30
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 8,9-dihydronaphtho[2,3-g]quinoline?
The IUPAC name of 8,9-dihydronaphtho[2,3-g]quinoline (CID 130290942) is 8,9-dihydronaphtho[2,3-g]quinoline.
What is the SMILES notation for 8,9-dihydronaphtho[2,3-g]quinoline?
The canonical SMILES for 8,9-dihydronaphtho[2,3-g]quinoline is C1=c2cc3cc4cccnc4cc3cc2=CCC1.
What is the InChIKey of 8,9-dihydronaphtho[2,3-g]quinoline?
The InChIKey is BTMHNVXGXWEZQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N/c1-2-5-13-9-16-11-17-14(6-3-7-18-17)10-15(16)8-12(13)4-1/h3-11H,1-2H2.
What are the key properties of 8,9-dihydronaphtho[2,3-g]quinoline?
8,9-dihydronaphtho[2,3-g]quinoline has a molecular weight of 231.30 g/mol, XLogP of 2.74, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8,9-dihydronaphtho[2,3-g]quinoline is sourced from PubChem (CID 130290942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).