4-ethyl-6-piperazin-1-ylpyrimidine

C10H16N4 — CID 21473370

IUPAC4-ethyl-6-piperazin-1-ylpyrimidine
SMILESCCc1cc(N2CCNCC2)ncn1
InChIInChI=1S/C10H16N4/c1-2-9-7-10(13-8-12-9)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3
InChIKeyIVAHAFXZXGBFQQ-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.45
Rot. Bonds2

About 4-ethyl-6-piperazin-1-ylpyrimidine

4-ethyl-6-piperazin-1-ylpyrimidine (PubChem CID 21473370) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 4-ethyl-6-piperazin-1-ylpyrimidine.

Molecular Properties

Compound Name4-ethyl-6-piperazin-1-ylpyrimidine
PubChem CID21473370
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name4-ethyl-6-piperazin-1-ylpyrimidine
SMILESCCc1cc(N2CCNCC2)ncn1
InChIInChI=1S/C10H16N4/c1-2-9-7-10(13-8-12-9)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3
InChIKeyIVAHAFXZXGBFQQ-UHFFFAOYSA-N
XLogP0.45
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-piperazin-1-ylpyrimidine?
The IUPAC name of 4-ethyl-6-piperazin-1-ylpyrimidine (CID 21473370) is 4-ethyl-6-piperazin-1-ylpyrimidine.
What is the SMILES notation for 4-ethyl-6-piperazin-1-ylpyrimidine?
The canonical SMILES for 4-ethyl-6-piperazin-1-ylpyrimidine is CCc1cc(N2CCNCC2)ncn1.
What is the InChIKey of 4-ethyl-6-piperazin-1-ylpyrimidine?
The InChIKey is IVAHAFXZXGBFQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-2-9-7-10(13-8-12-9)14-5-3-11-4-6-14/h7-8,11H,2-6H2,1H3.
What are the key properties of 4-ethyl-6-piperazin-1-ylpyrimidine?
4-ethyl-6-piperazin-1-ylpyrimidine has a molecular weight of 192.27 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-piperazin-1-ylpyrimidine is sourced from PubChem (CID 21473370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).