8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline

C21H20N4O — CID 59483960

IUPAC8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline
SMILESCc1cc(-n2ccnc2)c2cccc(OCc3c(C)ccnc3C)c2n1
InChIInChI=1S/C21H20N4O/c1-14-7-8-23-16(3)18(14)12-26-20-6-4-5-17-19(25-10-9-22-13-25)11-15(2)24-21(17)20/h4-11,13H,12H2,1-3H3
InChIKeyYZTPGOPKGSBCMO-UHFFFAOYSA-N
MW344.42 g/mol
LogP4.32
Rot. Bonds4

About 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline

8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline (PubChem CID 59483960) has the molecular formula C21H20N4O and a molecular weight of 344.42 g/mol. Its IUPAC name is 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline.

Molecular Properties

Compound Name8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline
PubChem CID59483960
Molecular FormulaC21H20N4O
Molecular Weight344.42 g/mol
Exact Mass344.16
IUPAC Name8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline
SMILESCc1cc(-n2ccnc2)c2cccc(OCc3c(C)ccnc3C)c2n1
InChIInChI=1S/C21H20N4O/c1-14-7-8-23-16(3)18(14)12-26-20-6-4-5-17-19(25-10-9-22-13-25)11-15(2)24-21(17)20/h4-11,13H,12H2,1-3H3
InChIKeyYZTPGOPKGSBCMO-UHFFFAOYSA-N
XLogP4.32
TPSA52.83 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline?
The IUPAC name of 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline (CID 59483960) is 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline.
What is the SMILES notation for 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline?
The canonical SMILES for 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline is Cc1cc(-n2ccnc2)c2cccc(OCc3c(C)ccnc3C)c2n1.
What is the InChIKey of 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline?
The InChIKey is YZTPGOPKGSBCMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O/c1-14-7-8-23-16(3)18(14)12-26-20-6-4-5-17-19(25-10-9-22-13-25)11-15(2)24-21(17)20/h4-11,13H,12H2,1-3H3.
What are the key properties of 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline?
8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline has a molecular weight of 344.42 g/mol, XLogP of 4.32, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[(2,4-dimethyl-3-pyridinyl)methoxy]-4-imidazol-1-yl-2-methylquinoline is sourced from PubChem (CID 59483960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).