2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole

C19H13F2N5O2 — CID 167518459

IUPAC2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole
SMILESCOc1cc(-c2cc(-c3nnc(-c4ccc(F)cn4)o3)nc(C)c2F)ccn1
InChIInChI=1S/C19H13F2N5O2/c1-10-17(21)13(11-5-6-22-16(7-11)27-2)8-15(24-10)19-26-25-18(28-19)14-4-3-12(20)9-23-14/h3-9H,1-2H3
InChIKeyGEVDSTAPUXMVPN-UHFFFAOYSA-N
MW381.34 g/mol
LogP3.85
Rot. Bonds4

About 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole

2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole (PubChem CID 167518459) has the molecular formula C19H13F2N5O2 and a molecular weight of 381.34 g/mol. Its IUPAC name is 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole
PubChem CID167518459
Molecular FormulaC19H13F2N5O2
Molecular Weight381.34 g/mol
Exact Mass381.10
IUPAC Name2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole
SMILESCOc1cc(-c2cc(-c3nnc(-c4ccc(F)cn4)o3)nc(C)c2F)ccn1
InChIInChI=1S/C19H13F2N5O2/c1-10-17(21)13(11-5-6-22-16(7-11)27-2)8-15(24-10)19-26-25-18(28-19)14-4-3-12(20)9-23-14/h3-9H,1-2H3
InChIKeyGEVDSTAPUXMVPN-UHFFFAOYSA-N
XLogP3.85
TPSA86.82 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.34
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole with MolForge

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Related Compounds

2-[4-(1-ethylpyrazol-4-yl)-5-fluoro-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole
CID 167518278
4-(2-fluoro-3-methylphenyl)-2-methoxypyridine
CID 178155180
3-[4-(6-chloro-3-pyridinyl)-5-fluoro-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazole
CID 167518349
[5-fluoro-2-(2-methoxy-4-pyridinyl)phenyl]methanamine
CID 114078578
ethane;3-(5-fluoro-2-pyridinyl)-4,5,6-trimethylpyridazine
CID 169124065
4-(2,4-dimethylphenyl)-2-methoxypyridine
CID 90207417
5-fluoro-2-(2-fluoro-3-methoxyphenyl)pyridine
CID 50961650
4-(3-fluoro-5-methyl-1H-pyrazol-4-yl)-2-methoxypyridine
CID 139926073
2-bromo-4-fluoro-6-(2-methoxy-4-pyridinyl)aniline
CID 153356943
4-(3-fluoro-5-propan-2-ylphenyl)-2-methoxypyridine
CID 146318053
5-fluoro-2-methoxy-N-[3-methoxy-5-(2-methoxy-4-pyridinyl)-2-pyridinyl]benzamide
CID 169439416
3-fluoro-5-(2-methoxy-4-pyridinyl)phenol
CID 83130700

Frequently Asked Questions

What is the IUPAC name of 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole?
The IUPAC name of 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole (CID 167518459) is 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole is COc1cc(-c2cc(-c3nnc(-c4ccc(F)cn4)o3)nc(C)c2F)ccn1.
What is the InChIKey of 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole?
The InChIKey is GEVDSTAPUXMVPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N5O2/c1-10-17(21)13(11-5-6-22-16(7-11)27-2)8-15(24-10)19-26-25-18(28-19)14-4-3-12(20)9-23-14/h3-9H,1-2H3.
What are the key properties of 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole?
2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole has a molecular weight of 381.34 g/mol, XLogP of 3.85, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-fluoro-4-(2-methoxy-4-pyridinyl)-6-methyl-2-pyridinyl]-5-(5-fluoro-2-pyridinyl)-1,3,4-oxadiazole is sourced from PubChem (CID 167518459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).