5-ethyl-2-piperidin-4-ylpyrimidine

C11H17N3 — CID 83697990

IUPAC5-ethyl-2-piperidin-4-ylpyrimidine
SMILESCCc1cnc(C2CCNCC2)nc1
InChIInChI=1S/C11H17N3/c1-2-9-7-13-11(14-8-9)10-3-5-12-6-4-10/h7-8,10,12H,2-6H2,1H3
InChIKeyBHWJHENQEZKTLJ-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.51
Rot. Bonds2

About 5-ethyl-2-piperidin-4-ylpyrimidine

5-ethyl-2-piperidin-4-ylpyrimidine (PubChem CID 83697990) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 5-ethyl-2-piperidin-4-ylpyrimidine.

Molecular Properties

Compound Name5-ethyl-2-piperidin-4-ylpyrimidine
PubChem CID83697990
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name5-ethyl-2-piperidin-4-ylpyrimidine
SMILESCCc1cnc(C2CCNCC2)nc1
InChIInChI=1S/C11H17N3/c1-2-9-7-13-11(14-8-9)10-3-5-12-6-4-10/h7-8,10,12H,2-6H2,1H3
InChIKeyBHWJHENQEZKTLJ-UHFFFAOYSA-N
XLogP1.51
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-piperidin-4-ylpyrimidine?
The IUPAC name of 5-ethyl-2-piperidin-4-ylpyrimidine (CID 83697990) is 5-ethyl-2-piperidin-4-ylpyrimidine.
What is the SMILES notation for 5-ethyl-2-piperidin-4-ylpyrimidine?
The canonical SMILES for 5-ethyl-2-piperidin-4-ylpyrimidine is CCc1cnc(C2CCNCC2)nc1.
What is the InChIKey of 5-ethyl-2-piperidin-4-ylpyrimidine?
The InChIKey is BHWJHENQEZKTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-2-9-7-13-11(14-8-9)10-3-5-12-6-4-10/h7-8,10,12H,2-6H2,1H3.
What are the key properties of 5-ethyl-2-piperidin-4-ylpyrimidine?
5-ethyl-2-piperidin-4-ylpyrimidine has a molecular weight of 191.28 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-piperidin-4-ylpyrimidine is sourced from PubChem (CID 83697990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).