4-methoxy-2-phenyl-3-pyridin-4-ylquinoline

C21H16N2O — CID 139651635

IUPAC4-methoxy-2-phenyl-3-pyridin-4-ylquinoline
SMILESCOc1c(-c2ccncc2)c(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C21H16N2O/c1-24-21-17-9-5-6-10-18(17)23-20(16-7-3-2-4-8-16)19(21)15-11-13-22-14-12-15/h2-14H,1H3
InChIKeyHUTYXBKSFNTLCU-UHFFFAOYSA-N
MW312.37 g/mol
LogP4.97
Rot. Bonds3

About 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline

4-methoxy-2-phenyl-3-pyridin-4-ylquinoline (PubChem CID 139651635) has the molecular formula C21H16N2O and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline.

Molecular Properties

Compound Name4-methoxy-2-phenyl-3-pyridin-4-ylquinoline
PubChem CID139651635
Molecular FormulaC21H16N2O
Molecular Weight312.37 g/mol
Exact Mass312.13
IUPAC Name4-methoxy-2-phenyl-3-pyridin-4-ylquinoline
SMILESCOc1c(-c2ccncc2)c(-c2ccccc2)nc2ccccc12
InChIInChI=1S/C21H16N2O/c1-24-21-17-9-5-6-10-18(17)23-20(16-7-3-2-4-8-16)19(21)15-11-13-22-14-12-15/h2-14H,1H3
InChIKeyHUTYXBKSFNTLCU-UHFFFAOYSA-N
XLogP4.97
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-methoxy-5-phenyl-2,6-dipyridin-4-ylpyrimidine
CID 23000521
4-chloro-2-(4-fluorophenyl)-3-pyridin-4-ylquinoline
CID 139651658
2-(4-methoxyphenyl)-3,4-dimethylquinoline;hydrochloride
CID 42918992
7,14-dimethyl-6,13-bis(4-pyridin-4-ylphenyl)quinolino[4,3-j]phenanthridine
CID 134595926
3-[(2-phenyl-3-pyridin-4-ylquinolin-4-yl)amino]propanoic acid
CID 139651637
2,3-bis(4-methoxyphenyl)quinoline-4-carboxylic acid
CID 95560580
4-chloro-6-fluoro-2-phenyl-3-pyridin-4-ylquinoline
CID 139651657
1-(2-methoxyphenyl)-3,4-diphenylisoquinoline
CID 102102468
6,11-dipyridin-4-ylbenzo[b]phenazine
CID 154692257
2-(4-methoxy-3-phenylquinolin-2-yl)sulfanylethanamine
CID 71321960
3-chloro-2,4-diphenylquinoline
CID 10781654
3-fluoro-2-phenyl-N-pyridin-4-ylquinolin-4-amine
CID 11301504

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline?
The IUPAC name of 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline (CID 139651635) is 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline.
What is the SMILES notation for 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline?
The canonical SMILES for 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline is COc1c(-c2ccncc2)c(-c2ccccc2)nc2ccccc12.
What is the InChIKey of 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline?
The InChIKey is HUTYXBKSFNTLCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N2O/c1-24-21-17-9-5-6-10-18(17)23-20(16-7-3-2-4-8-16)19(21)15-11-13-22-14-12-15/h2-14H,1H3.
What are the key properties of 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline?
4-methoxy-2-phenyl-3-pyridin-4-ylquinoline has a molecular weight of 312.37 g/mol, XLogP of 4.97, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-phenyl-3-pyridin-4-ylquinoline is sourced from PubChem (CID 139651635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).