3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine

C11H14N4O — CID 1481213

IUPAC3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine
SMILESCc1noc2ncnc(N3CCCCC3)c12
InChIInChI=1S/C11H14N4O/c1-8-9-10(15-5-3-2-4-6-15)12-7-13-11(9)16-14-8/h7H,2-6H2,1H3
InChIKeyOZKMGGDAFPVBQH-UHFFFAOYSA-N
MW218.26 g/mol
LogP1.92
Rot. Bonds1

About 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine

3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine (PubChem CID 1481213) has the molecular formula C11H14N4O and a molecular weight of 218.26 g/mol. Its IUPAC name is 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine.

Molecular Properties

Compound Name3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine
PubChem CID1481213
Molecular FormulaC11H14N4O
Molecular Weight218.26 g/mol
Exact Mass218.12
IUPAC Name3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine
SMILESCc1noc2ncnc(N3CCCCC3)c12
InChIInChI=1S/C11H14N4O/c1-8-9-10(15-5-3-2-4-6-15)12-7-13-11(9)16-14-8/h7H,2-6H2,1H3
InChIKeyOZKMGGDAFPVBQH-UHFFFAOYSA-N
XLogP1.92
TPSA55.05 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.26
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine?
The IUPAC name of 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine (CID 1481213) is 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine.
What is the SMILES notation for 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine?
The canonical SMILES for 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine is Cc1noc2ncnc(N3CCCCC3)c12.
What is the InChIKey of 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine?
The InChIKey is OZKMGGDAFPVBQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4O/c1-8-9-10(15-5-3-2-4-6-15)12-7-13-11(9)16-14-8/h7H,2-6H2,1H3.
What are the key properties of 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine?
3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine has a molecular weight of 218.26 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-piperidin-1-yl-[1,2]oxazolo[5,4-d]pyrimidine is sourced from PubChem (CID 1481213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).