4-methyl-2-phenylquinoline

C16H13N — CID 20919

IUPAC4-methyl-2-phenylquinoline
SMILESCc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C16H13N/c1-12-11-16(13-7-3-2-4-8-13)17-15-10-6-5-9-14(12)15/h2-11H,1H3
InChIKeyLPDYVLMKILCHDE-UHFFFAOYSA-N
MW219.29 g/mol
LogP4.21
Rot. Bonds1

About 4-methyl-2-phenylquinoline

4-methyl-2-phenylquinoline (PubChem CID 20919) has the molecular formula C16H13N and a molecular weight of 219.29 g/mol. Its IUPAC name is 4-methyl-2-phenylquinoline.

Molecular Properties

Compound Name4-methyl-2-phenylquinoline
PubChem CID20919
Molecular FormulaC16H13N
Molecular Weight219.29 g/mol
Exact Mass219.10
IUPAC Name4-methyl-2-phenylquinoline
SMILESCc1cc(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C16H13N/c1-12-11-16(13-7-3-2-4-8-13)17-15-10-6-5-9-14(12)15/h2-11H,1H3
InChIKeyLPDYVLMKILCHDE-UHFFFAOYSA-N
XLogP4.21
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-phenylquinoline?
The IUPAC name of 4-methyl-2-phenylquinoline (CID 20919) is 4-methyl-2-phenylquinoline.
What is the SMILES notation for 4-methyl-2-phenylquinoline?
The canonical SMILES for 4-methyl-2-phenylquinoline is Cc1cc(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 4-methyl-2-phenylquinoline?
The InChIKey is LPDYVLMKILCHDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N/c1-12-11-16(13-7-3-2-4-8-13)17-15-10-6-5-9-14(12)15/h2-11H,1H3.
What are the key properties of 4-methyl-2-phenylquinoline?
4-methyl-2-phenylquinoline has a molecular weight of 219.29 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-phenylquinoline is sourced from PubChem (CID 20919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).