4,5,6-trimethyl-2-piperidin-4-ylpyrimidine

C12H19N3 — CID 63317217

IUPAC4,5,6-trimethyl-2-piperidin-4-ylpyrimidine
SMILESCc1nc(C2CCNCC2)nc(C)c1C
InChIInChI=1S/C12H19N3/c1-8-9(2)14-12(15-10(8)3)11-4-6-13-7-5-11/h11,13H,4-7H2,1-3H3
InChIKeyOSEAPIHWSPIMFC-UHFFFAOYSA-N
MW205.30 g/mol
LogP1.87
Rot. Bonds1

About 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine

4,5,6-trimethyl-2-piperidin-4-ylpyrimidine (PubChem CID 63317217) has the molecular formula C12H19N3 and a molecular weight of 205.30 g/mol. Its IUPAC name is 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine.

Molecular Properties

Compound Name4,5,6-trimethyl-2-piperidin-4-ylpyrimidine
PubChem CID63317217
Molecular FormulaC12H19N3
Molecular Weight205.30 g/mol
Exact Mass205.16
IUPAC Name4,5,6-trimethyl-2-piperidin-4-ylpyrimidine
SMILESCc1nc(C2CCNCC2)nc(C)c1C
InChIInChI=1S/C12H19N3/c1-8-9(2)14-12(15-10(8)3)11-4-6-13-7-5-11/h11,13H,4-7H2,1-3H3
InChIKeyOSEAPIHWSPIMFC-UHFFFAOYSA-N
XLogP1.87
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine?
The IUPAC name of 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine (CID 63317217) is 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine.
What is the SMILES notation for 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine?
The canonical SMILES for 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine is Cc1nc(C2CCNCC2)nc(C)c1C.
What is the InChIKey of 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine?
The InChIKey is OSEAPIHWSPIMFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-8-9(2)14-12(15-10(8)3)11-4-6-13-7-5-11/h11,13H,4-7H2,1-3H3.
What are the key properties of 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine?
4,5,6-trimethyl-2-piperidin-4-ylpyrimidine has a molecular weight of 205.30 g/mol, XLogP of 1.87, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,6-trimethyl-2-piperidin-4-ylpyrimidine is sourced from PubChem (CID 63317217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).