1,2-oxazole;1,3-oxazole;pyridine;pyrimidine

C15H15N5O2 — CID 158432652

IUPAC1,2-oxazole;1,3-oxazole;pyridine;pyrimidine
SMILESc1ccncc1.c1cncnc1.c1cnoc1.c1cocn1
InChIInChI=1S/C5H5N.C4H4N2.2C3H3NO/c1-2-4-6-5-3-1;1-2-5-4-6-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;1-4H;2*1-3H
InChIKeyHBVQKDCXXFKNTL-UHFFFAOYSA-N
MW297.32 g/mol
LogP2.91
Rot. Bonds

About 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine

1,2-oxazole;1,3-oxazole;pyridine;pyrimidine (PubChem CID 158432652) has the molecular formula C15H15N5O2 and a molecular weight of 297.32 g/mol. Its IUPAC name is 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine.

Molecular Properties

Compound Name1,2-oxazole;1,3-oxazole;pyridine;pyrimidine
PubChem CID158432652
Molecular FormulaC15H15N5O2
Molecular Weight297.32 g/mol
Exact Mass297.12
IUPAC Name1,2-oxazole;1,3-oxazole;pyridine;pyrimidine
SMILESc1ccncc1.c1cncnc1.c1cnoc1.c1cocn1
InChIInChI=1S/C5H5N.C4H4N2.2C3H3NO/c1-2-4-6-5-3-1;1-2-5-4-6-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;1-4H;2*1-3H
InChIKeyHBVQKDCXXFKNTL-UHFFFAOYSA-N
XLogP2.91
TPSA90.73 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.32
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

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1,2-oxazole;selane
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imidazol-3-ide;1,3,4-oxadiazole;1,2-oxazole;1,3-oxazole;pyrazine;pyridine;pyrimidine;quinoline;quinoxaline;1,3-thiazole;yttrium
CID 157458212
4H-imidazole;1,2,4-oxadiazole;1,3,4-oxadiazole;1,2-oxazole;1,3-oxazole;pyrazine;pyridazine;pyridine;pyrimidine;2H-pyrrole;3H-pyrrole;1,2,4-triazine
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Frequently Asked Questions

What is the IUPAC name of 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine?
The IUPAC name of 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine (CID 158432652) is 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine.
What is the SMILES notation for 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine?
The canonical SMILES for 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine is c1ccncc1.c1cncnc1.c1cnoc1.c1cocn1.
What is the InChIKey of 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine?
The InChIKey is HBVQKDCXXFKNTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N.C4H4N2.2C3H3NO/c1-2-4-6-5-3-1;1-2-5-4-6-3-1;1-2-5-3-4-1;1-2-4-5-3-1/h1-5H;1-4H;2*1-3H.
What are the key properties of 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine?
1,2-oxazole;1,3-oxazole;pyridine;pyrimidine has a molecular weight of 297.32 g/mol, XLogP of 2.91, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazole;1,3-oxazole;pyridine;pyrimidine is sourced from PubChem (CID 158432652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).