1,2-oxazole;1H-pyrazole;thiophene;2H-triazole

C12H14N6OS — CID 159713301

IUPAC1,2-oxazole;1H-pyrazole;thiophene;2H-triazole
SMILESc1ccsc1.c1cn[nH]c1.c1cn[nH]n1.c1cnoc1
InChIInChI=1S/C4H4S.C3H4N2.C3H3NO.C2H3N3/c4*1-2-4-5-3-1/h1-4H;1-3H,(H,4,5);1-3H;1-2H,(H,3,4,5)
InChIKeyMZCPSZSNMPSWAF-UHFFFAOYSA-N
MW290.35 g/mol
LogP2.64
Rot. Bonds

About 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole

1,2-oxazole;1H-pyrazole;thiophene;2H-triazole (PubChem CID 159713301) has the molecular formula C12H14N6OS and a molecular weight of 290.35 g/mol. Its IUPAC name is 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole.

Molecular Properties

Compound Name1,2-oxazole;1H-pyrazole;thiophene;2H-triazole
PubChem CID159713301
Molecular FormulaC12H14N6OS
Molecular Weight290.35 g/mol
Exact Mass290.09
IUPAC Name1,2-oxazole;1H-pyrazole;thiophene;2H-triazole
SMILESc1ccsc1.c1cn[nH]c1.c1cn[nH]n1.c1cnoc1
InChIInChI=1S/C4H4S.C3H4N2.C3H3NO.C2H3N3/c4*1-2-4-5-3-1/h1-4H;1-3H,(H,4,5);1-3H;1-2H,(H,3,4,5)
InChIKeyMZCPSZSNMPSWAF-UHFFFAOYSA-N
XLogP2.64
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.35
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole?
The IUPAC name of 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole (CID 159713301) is 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole.
What is the SMILES notation for 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole?
The canonical SMILES for 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole is c1ccsc1.c1cn[nH]c1.c1cn[nH]n1.c1cnoc1.
What is the InChIKey of 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole?
The InChIKey is MZCPSZSNMPSWAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4S.C3H4N2.C3H3NO.C2H3N3/c4*1-2-4-5-3-1/h1-4H;1-3H,(H,4,5);1-3H;1-2H,(H,3,4,5).
What are the key properties of 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole?
1,2-oxazole;1H-pyrazole;thiophene;2H-triazole has a molecular weight of 290.35 g/mol, XLogP of 2.64, 0 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazole;1H-pyrazole;thiophene;2H-triazole is sourced from PubChem (CID 159713301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).