5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole

C21H20N4O2 — CID 23248323

IUPAC5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole
SMILESCc1oc(C(C)(C)c2nc(-c3ccncc3)c(C)o2)nc1-c1ccncc1
InChIInChI=1S/C21H20N4O2/c1-13-17(15-5-9-22-10-6-15)24-19(26-13)21(3,4)20-25-18(14(2)27-20)16-7-11-23-12-8-16/h5-12H,1-4H3
InChIKeyRJLJPNYYZVDZFK-UHFFFAOYSA-N
MW360.42 g/mol
LogP4.73
Rot. Bonds4

About 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole

5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole (PubChem CID 23248323) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole.

Molecular Properties

Compound Name5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole
PubChem CID23248323
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC Name5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole
SMILESCc1oc(C(C)(C)c2nc(-c3ccncc3)c(C)o2)nc1-c1ccncc1
InChIInChI=1S/C21H20N4O2/c1-13-17(15-5-9-22-10-6-15)24-19(26-13)21(3,4)20-25-18(14(2)27-20)16-7-11-23-12-8-16/h5-12H,1-4H3
InChIKeyRJLJPNYYZVDZFK-UHFFFAOYSA-N
XLogP4.73
TPSA77.84 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole?
The IUPAC name of 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole (CID 23248323) is 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole.
What is the SMILES notation for 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole?
The canonical SMILES for 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole is Cc1oc(C(C)(C)c2nc(-c3ccncc3)c(C)o2)nc1-c1ccncc1.
What is the InChIKey of 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole?
The InChIKey is RJLJPNYYZVDZFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-13-17(15-5-9-22-10-6-15)24-19(26-13)21(3,4)20-25-18(14(2)27-20)16-7-11-23-12-8-16/h5-12H,1-4H3.
What are the key properties of 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole?
5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole has a molecular weight of 360.42 g/mol, XLogP of 4.73, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-[2-(5-methyl-4-pyridin-4-yl-1,3-oxazol-2-yl)propan-2-yl]-4-pyridin-4-yl-1,3-oxazole is sourced from PubChem (CID 23248323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).