6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine

C13H18N4 — CID 162521814

IUPAC6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine
SMILESCc1nc2nccn2c(N2CCCCC2)c1C
InChIInChI=1S/C13H18N4/c1-10-11(2)15-13-14-6-9-17(13)12(10)16-7-4-3-5-8-16/h6,9H,3-5,7-8H2,1-2H3
InChIKeyXYOMTIJMZDCOKH-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.34
Rot. Bonds1

About 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine

6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine (PubChem CID 162521814) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine
PubChem CID162521814
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine
SMILESCc1nc2nccn2c(N2CCCCC2)c1C
InChIInChI=1S/C13H18N4/c1-10-11(2)15-13-14-6-9-17(13)12(10)16-7-4-3-5-8-16/h6,9H,3-5,7-8H2,1-2H3
InChIKeyXYOMTIJMZDCOKH-UHFFFAOYSA-N
XLogP2.34
TPSA33.43 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine?
The IUPAC name of 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine (CID 162521814) is 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine is Cc1nc2nccn2c(N2CCCCC2)c1C.
What is the InChIKey of 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine?
The InChIKey is XYOMTIJMZDCOKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-10-11(2)15-13-14-6-9-17(13)12(10)16-7-4-3-5-8-16/h6,9H,3-5,7-8H2,1-2H3.
What are the key properties of 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine?
6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine has a molecular weight of 230.31 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-dimethyl-5-piperidin-1-ylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 162521814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).