naphtho[1,2-h]quinoline

C17H11N — CID 9174

IUPACnaphtho[1,2-h]quinoline
SMILESc1ccc2c(c1)ccc1c2ccc2cccnc21
InChIInChI=1S/C17H11N/c1-2-6-14-12(4-1)7-10-16-15(14)9-8-13-5-3-11-18-17(13)16/h1-11H
InChIKeyOZIRORHUKSXTLG-UHFFFAOYSA-N
MW229.28 g/mol
LogP4.54
Rot. Bonds

About naphtho[1,2-h]quinoline

naphtho[1,2-h]quinoline (PubChem CID 9174) has the molecular formula C17H11N and a molecular weight of 229.28 g/mol. Its IUPAC name is naphtho[1,2-h]quinoline.

Molecular Properties

Compound Namenaphtho[1,2-h]quinoline
PubChem CID9174
Molecular FormulaC17H11N
Molecular Weight229.28 g/mol
Exact Mass229.09
IUPAC Namenaphtho[1,2-h]quinoline
SMILESc1ccc2c(c1)ccc1c2ccc2cccnc21
InChIInChI=1S/C17H11N/c1-2-6-14-12(4-1)7-10-16-15(14)9-8-13-5-3-11-18-17(13)16/h1-11H
InChIKeyOZIRORHUKSXTLG-UHFFFAOYSA-N
XLogP4.54
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of naphtho[1,2-h]quinoline?
The IUPAC name of naphtho[1,2-h]quinoline (CID 9174) is naphtho[1,2-h]quinoline.
What is the SMILES notation for naphtho[1,2-h]quinoline?
The canonical SMILES for naphtho[1,2-h]quinoline is c1ccc2c(c1)ccc1c2ccc2cccnc21.
What is the InChIKey of naphtho[1,2-h]quinoline?
The InChIKey is OZIRORHUKSXTLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N/c1-2-6-14-12(4-1)7-10-16-15(14)9-8-13-5-3-11-18-17(13)16/h1-11H.
What are the key properties of naphtho[1,2-h]quinoline?
naphtho[1,2-h]quinoline has a molecular weight of 229.28 g/mol, XLogP of 4.54, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for naphtho[1,2-h]quinoline is sourced from PubChem (CID 9174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).