naphtho[2,3-h]quinoline

C17H11N — CID 6774

IUPACnaphtho[2,3-h]quinoline
SMILESc1ccc2cc3c(ccc4cccnc43)cc2c1
InChIInChI=1S/C17H11N/c1-2-5-14-11-16-15(10-13(14)4-1)8-7-12-6-3-9-18-17(12)16/h1-11H
InChIKeyJKJNHQJWGCHSHP-UHFFFAOYSA-N
MW229.28 g/mol
LogP4.54
Rot. Bonds

About naphtho[2,3-h]quinoline

naphtho[2,3-h]quinoline (PubChem CID 6774) has the molecular formula C17H11N and a molecular weight of 229.28 g/mol. Its IUPAC name is naphtho[2,3-h]quinoline.

Molecular Properties

Compound Namenaphtho[2,3-h]quinoline
PubChem CID6774
Molecular FormulaC17H11N
Molecular Weight229.28 g/mol
Exact Mass229.09
IUPAC Namenaphtho[2,3-h]quinoline
SMILESc1ccc2cc3c(ccc4cccnc43)cc2c1
InChIInChI=1S/C17H11N/c1-2-5-14-11-16-15(10-13(14)4-1)8-7-12-6-3-9-18-17(12)16/h1-11H
InChIKeyJKJNHQJWGCHSHP-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_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Related Compounds

Quinoline
CID 7047
Benz(c)acridine
CID 9181
6-Methylquinoline
CID 7059
1,10-Phenanthroline
CID 1318
Ellipticine
CID 3213
4-Methylquinoline
CID 10285
Benzo(F)Quinoline
CID 6796
4,7-Diphenyl-1,10-phenanthroline
CID 72812
Dibenz(a,j)acridine
CID 9177
DIBENZ(a,h)ACRIDINE
CID 9183
Dibenz(c,h)acridine
CID 9178
8-Methylquinoline
CID 11910

Frequently Asked Questions

What is the IUPAC name of naphtho[2,3-h]quinoline?
The IUPAC name of naphtho[2,3-h]quinoline (CID 6774) is naphtho[2,3-h]quinoline.
What is the SMILES notation for naphtho[2,3-h]quinoline?
The canonical SMILES for naphtho[2,3-h]quinoline is c1ccc2cc3c(ccc4cccnc43)cc2c1.
What is the InChIKey of naphtho[2,3-h]quinoline?
The InChIKey is JKJNHQJWGCHSHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H11N/c1-2-5-14-11-16-15(10-13(14)4-1)8-7-12-6-3-9-18-17(12)16/h1-11H.
What are the key properties of naphtho[2,3-h]quinoline?
naphtho[2,3-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[2,3-h]quinoline is sourced from PubChem (CID 6774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).