4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole

C11H20N4O — CID 174824500

IUPAC4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole
SMILESC1=NCCO1.C1CCNCC1.c1cn[nH]c1
InChIInChI=1S/C5H11N.C3H4N2.C3H5NO/c1-2-4-6-5-3-1;1-2-4-5-3-1;1-2-5-3-4-1/h6H,1-5H2;1-3H,(H,4,5);3H,1-2H2
InChIKeyRHVNMOQTZKMKSQ-UHFFFAOYSA-N
MW224.31 g/mol
LogP1.21
Rot. Bonds

About 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole

4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole (PubChem CID 174824500) has the molecular formula C11H20N4O and a molecular weight of 224.31 g/mol. Its IUPAC name is 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole.

Molecular Properties

Compound Name4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole
PubChem CID174824500
Molecular FormulaC11H20N4O
Molecular Weight224.31 g/mol
Exact Mass224.16
IUPAC Name4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole
SMILESC1=NCCO1.C1CCNCC1.c1cn[nH]c1
InChIInChI=1S/C5H11N.C3H4N2.C3H5NO/c1-2-4-6-5-3-1;1-2-4-5-3-1;1-2-5-3-4-1/h6H,1-5H2;1-3H,(H,4,5);3H,1-2H2
InChIKeyRHVNMOQTZKMKSQ-UHFFFAOYSA-N
XLogP1.21
TPSA62.30 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.31
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole?
The IUPAC name of 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole (CID 174824500) is 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole.
What is the SMILES notation for 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole?
The canonical SMILES for 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole is C1=NCCO1.C1CCNCC1.c1cn[nH]c1.
What is the InChIKey of 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole?
The InChIKey is RHVNMOQTZKMKSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11N.C3H4N2.C3H5NO/c1-2-4-6-5-3-1;1-2-4-5-3-1;1-2-5-3-4-1/h6H,1-5H2;1-3H,(H,4,5);3H,1-2H2.
What are the key properties of 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole?
4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole has a molecular weight of 224.31 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dihydro-1,3-oxazole;piperidine;1H-pyrazole is sourced from PubChem (CID 174824500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).