4-chloro-2-methylbenzo[g]quinoline

C14H10ClN — CID 918958

IUPAC4-chloro-2-methylbenzo[g]quinoline
SMILESCc1cc(Cl)c2cc3ccccc3cc2n1
InChIInChI=1S/C14H10ClN/c1-9-6-13(15)12-7-10-4-2-3-5-11(10)8-14(12)16-9/h2-8H,1H3
InChIKeyGKASXJNGYJWOFO-UHFFFAOYSA-N
MW227.69 g/mol
LogP4.35
Rot. Bonds

About 4-chloro-2-methylbenzo[g]quinoline

4-chloro-2-methylbenzo[g]quinoline (PubChem CID 918958) has the molecular formula C14H10ClN and a molecular weight of 227.69 g/mol. Its IUPAC name is 4-chloro-2-methylbenzo[g]quinoline.

Molecular Properties

Compound Name4-chloro-2-methylbenzo[g]quinoline
PubChem CID918958
Molecular FormulaC14H10ClN
Molecular Weight227.69 g/mol
Exact Mass227.05
IUPAC Name4-chloro-2-methylbenzo[g]quinoline
SMILESCc1cc(Cl)c2cc3ccccc3cc2n1
InChIInChI=1S/C14H10ClN/c1-9-6-13(15)12-7-10-4-2-3-5-11(10)8-14(12)16-9/h2-8H,1H3
InChIKeyGKASXJNGYJWOFO-UHFFFAOYSA-N
XLogP4.35
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.69
LogP ≤ 54.35
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 4-chloro-2-methylbenzo[g]quinoline?
The IUPAC name of 4-chloro-2-methylbenzo[g]quinoline (CID 918958) is 4-chloro-2-methylbenzo[g]quinoline.
What is the SMILES notation for 4-chloro-2-methylbenzo[g]quinoline?
The canonical SMILES for 4-chloro-2-methylbenzo[g]quinoline is Cc1cc(Cl)c2cc3ccccc3cc2n1.
What is the InChIKey of 4-chloro-2-methylbenzo[g]quinoline?
The InChIKey is GKASXJNGYJWOFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClN/c1-9-6-13(15)12-7-10-4-2-3-5-11(10)8-14(12)16-9/h2-8H,1H3.
What are the key properties of 4-chloro-2-methylbenzo[g]quinoline?
4-chloro-2-methylbenzo[g]quinoline has a molecular weight of 227.69 g/mol, XLogP of 4.35, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-methylbenzo[g]quinoline is sourced from PubChem (CID 918958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).