2,4-di(piperidin-3-yl)-1,3-oxazole

C13H21N3O — CID 115040991

IUPAC2,4-di(piperidin-3-yl)-1,3-oxazole
SMILESc1oc(C2CCCNC2)nc1C1CCCNC1
InChIInChI=1S/C13H21N3O/c1-3-10(7-14-5-1)12-9-17-13(16-12)11-4-2-6-15-8-11/h9-11,14-15H,1-8H2
InChIKeyVWWWGSJGUZAGTC-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.61
Rot. Bonds2

About 2,4-di(piperidin-3-yl)-1,3-oxazole

2,4-di(piperidin-3-yl)-1,3-oxazole (PubChem CID 115040991) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 2,4-di(piperidin-3-yl)-1,3-oxazole.

Molecular Properties

Compound Name2,4-di(piperidin-3-yl)-1,3-oxazole
PubChem CID115040991
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name2,4-di(piperidin-3-yl)-1,3-oxazole
SMILESc1oc(C2CCCNC2)nc1C1CCCNC1
InChIInChI=1S/C13H21N3O/c1-3-10(7-14-5-1)12-9-17-13(16-12)11-4-2-6-15-8-11/h9-11,14-15H,1-8H2
InChIKeyVWWWGSJGUZAGTC-UHFFFAOYSA-N
XLogP1.61
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-(oxan-4-yl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 115033401
4-(oxolan-3-yl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 115025819
2-(2-methylpropyl)-4-piperidin-3-yl-1,3-oxazole
CID 105462141
4-benzyl-2-piperidin-3-yl-1,3-oxazole
CID 115044768
2-(2-piperidin-3-yl-1,3-oxazol-4-yl)propan-1-amine
CID 115082647
3,5-di(piperidin-3-yl)-1,2,4-oxadiazole
CID 115077690
3-cyclobutyl-5-[(3R)-piperidin-3-yl]-1,2,4-oxadiazole
CID 96818005
3-cyclobutyl-5-[(3S)-piperidin-3-yl]-1,2,4-oxadiazole
CID 96818006
3-cyclopentyl-5-[(3R)-piperidin-3-yl]-1,2,4-oxadiazole
CID 93357413
4-[2-(azetidin-3-yl)-1,3-oxazol-4-yl]thiane 1,1-dioxide
CID 115047857
4-(difluoromethyl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 84770649
4-(fluoromethyl)-2-pyrrolidin-3-yl-1,3-oxazole
CID 84765750

Frequently Asked Questions

What is the IUPAC name of 2,4-di(piperidin-3-yl)-1,3-oxazole?
The IUPAC name of 2,4-di(piperidin-3-yl)-1,3-oxazole (CID 115040991) is 2,4-di(piperidin-3-yl)-1,3-oxazole.
What is the SMILES notation for 2,4-di(piperidin-3-yl)-1,3-oxazole?
The canonical SMILES for 2,4-di(piperidin-3-yl)-1,3-oxazole is c1oc(C2CCCNC2)nc1C1CCCNC1.
What is the InChIKey of 2,4-di(piperidin-3-yl)-1,3-oxazole?
The InChIKey is VWWWGSJGUZAGTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-10(7-14-5-1)12-9-17-13(16-12)11-4-2-6-15-8-11/h9-11,14-15H,1-8H2.
What are the key properties of 2,4-di(piperidin-3-yl)-1,3-oxazole?
2,4-di(piperidin-3-yl)-1,3-oxazole has a molecular weight of 235.33 g/mol, XLogP of 1.61, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-di(piperidin-3-yl)-1,3-oxazole is sourced from PubChem (CID 115040991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).