5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine

C13H18N4 — CID 83840539

IUPAC5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2c(C3CCCNC3)cnc2n1
InChIInChI=1S/C13H18N4/c1-9-6-10(2)17-12(8-15-13(17)16-9)11-4-3-5-14-7-11/h6,8,11,14H,3-5,7H2,1-2H3
InChIKeyQAJUEUJZUCFMBC-UHFFFAOYSA-N
MW230.31 g/mol
LogP1.81
Rot. Bonds1

About 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine

5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine (PubChem CID 83840539) has the molecular formula C13H18N4 and a molecular weight of 230.31 g/mol. Its IUPAC name is 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine
PubChem CID83840539
Molecular FormulaC13H18N4
Molecular Weight230.31 g/mol
Exact Mass230.15
IUPAC Name5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine
SMILESCc1cc(C)n2c(C3CCCNC3)cnc2n1
InChIInChI=1S/C13H18N4/c1-9-6-10(2)17-12(8-15-13(17)16-9)11-4-3-5-14-7-11/h6,8,11,14H,3-5,7H2,1-2H3
InChIKeyQAJUEUJZUCFMBC-UHFFFAOYSA-N
XLogP1.81
TPSA42.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
4,6-dimethyl-2-piperidin-3-ylpyrimidine;dihydrochloride
CID 71299007
4-cyclopentyl-6-methyl-2-piperidin-3-ylpyrimidine
CID 55203946
2-methyl-5-piperidin-3-ylpyrazine
CID 82599606
2,4-dimethyl-5-piperidin-3-ylpyridine
CID 83829631
6-methyl-2-[(3R)-piperidin-3-yl]-N-pyrazin-2-ylpyrimidin-4-amine
CID 95816713
2-methoxy-6-methyl-4-piperidin-3-ylpyridine
CID 146284880
6-methyl-2-[(3S)-piperidin-3-yl]-N-pyrimidin-2-ylpyrimidin-4-amine
CID 125027098
5-methyl-3-piperidin-3-ylimidazo[1,5-a]pyridine
CID 84740105
2-(difluoromethyl)-6-methyl-4-piperidin-3-ylpyridine
CID 146286074
12-[(3S)-piperidin-3-yl]-1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 67216754
(3S)-3-(1,4-dimethylimidazol-2-yl)piperidine
CID 96743464

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine?
The IUPAC name of 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine (CID 83840539) is 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine is Cc1cc(C)n2c(C3CCCNC3)cnc2n1.
What is the InChIKey of 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine?
The InChIKey is QAJUEUJZUCFMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4/c1-9-6-10(2)17-12(8-15-13(17)16-9)11-4-3-5-14-7-11/h6,8,11,14H,3-5,7H2,1-2H3.
What are the key properties of 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine?
5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine has a molecular weight of 230.31 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-3-piperidin-3-ylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 83840539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).