4-piperidin-2-yl-1,2-oxazole

C8H12N2O — CID 82417112

IUPAC4-piperidin-2-yl-1,2-oxazole
SMILESc1nocc1C1CCCCN1
InChIInChI=1S/C8H12N2O/c1-2-4-9-8(3-1)7-5-10-11-6-7/h5-6,8-9H,1-4H2
InChIKeyHWYGQASKHKLJDV-UHFFFAOYSA-N
MW152.20 g/mol
LogP1.49
Rot. Bonds1

About 4-piperidin-2-yl-1,2-oxazole

4-piperidin-2-yl-1,2-oxazole (PubChem CID 82417112) has the molecular formula C8H12N2O and a molecular weight of 152.20 g/mol. Its IUPAC name is 4-piperidin-2-yl-1,2-oxazole.

Molecular Properties

Compound Name4-piperidin-2-yl-1,2-oxazole
PubChem CID82417112
Molecular FormulaC8H12N2O
Molecular Weight152.20 g/mol
Exact Mass152.09
IUPAC Name4-piperidin-2-yl-1,2-oxazole
SMILESc1nocc1C1CCCCN1
InChIInChI=1S/C8H12N2O/c1-2-4-9-8(3-1)7-5-10-11-6-7/h5-6,8-9H,1-4H2
InChIKeyHWYGQASKHKLJDV-UHFFFAOYSA-N
XLogP1.49
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.20
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-piperidin-2-ylpyrimidin-2-amine
CID 82409904
4-cyclopentyl-1,2-oxazole;ethane
CID 142450092
2-pyridazin-4-ylazepane
CID 104670038
4-[(2S)-piperidin-2-yl]pyridazine;hydrochloride
CID 138376376
2-fluoro-5-[(2S)-piperidin-2-yl]pyridine
CID 55277900
4-piperidin-2-yl-1,2-thiazole
CID 56608136
(2S)-2-phenylpiperidine
CID 10997356
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;dihydrochloride
CID 164890613
2-chloro-5-[(2S)-piperidin-2-yl]pyridine;hydrochloride
CID 171194804
3-methyl-5-[(2R)-piperidin-2-yl]pyridine
CID 96741558
5-piperidin-2-yl-1,2-oxazol-4-amine
CID 115093519
3-bromo-5-piperidin-2-ylpyridine;dihydrochloride
CID 122198515

Frequently Asked Questions

What is the IUPAC name of 4-piperidin-2-yl-1,2-oxazole?
The IUPAC name of 4-piperidin-2-yl-1,2-oxazole (CID 82417112) is 4-piperidin-2-yl-1,2-oxazole.
What is the SMILES notation for 4-piperidin-2-yl-1,2-oxazole?
The canonical SMILES for 4-piperidin-2-yl-1,2-oxazole is c1nocc1C1CCCCN1.
What is the InChIKey of 4-piperidin-2-yl-1,2-oxazole?
The InChIKey is HWYGQASKHKLJDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N2O/c1-2-4-9-8(3-1)7-5-10-11-6-7/h5-6,8-9H,1-4H2.
What are the key properties of 4-piperidin-2-yl-1,2-oxazole?
4-piperidin-2-yl-1,2-oxazole has a molecular weight of 152.20 g/mol, XLogP of 1.49, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-piperidin-2-yl-1,2-oxazole is sourced from PubChem (CID 82417112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).