5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine

C11H18N4 — CID 103278300

IUPAC5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine
SMILESCCc1cnc(N2CCNCC2)nc1C
InChIInChI=1S/C11H18N4/c1-3-10-8-13-11(14-9(10)2)15-6-4-12-5-7-15/h8,12H,3-7H2,1-2H3
InChIKeyGVWDFWNHPFXRQA-UHFFFAOYSA-N
MW206.29 g/mol
LogP0.76
Rot. Bonds2

About 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine

5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine (PubChem CID 103278300) has the molecular formula C11H18N4 and a molecular weight of 206.29 g/mol. Its IUPAC name is 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine.

Molecular Properties

Compound Name5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine
PubChem CID103278300
Molecular FormulaC11H18N4
Molecular Weight206.29 g/mol
Exact Mass206.15
IUPAC Name5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine
SMILESCCc1cnc(N2CCNCC2)nc1C
InChIInChI=1S/C11H18N4/c1-3-10-8-13-11(14-9(10)2)15-6-4-12-5-7-15/h8,12H,3-7H2,1-2H3
InChIKeyGVWDFWNHPFXRQA-UHFFFAOYSA-N
XLogP0.76
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 50.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-butyl-7-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine-2,4-diamine
CID 137381348
1-(4,6-Dimethyl-2-pyrimidyl)piperazine
CID 2758651
5H,6H,7H,8H-pyrido(4,3-d)pyrimidine
CID 10932674
5H,6H,7H,8H-pyrido[3,4-d]pyrimidine
CID 21983612
6-Methyl-5,6,7,8-tetrahydro-pyrido[4,3-d]pyrimidin-2-ylamine
CID 12450594
2-Methyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidine
CID 11096174
4-Methyl-2-(piperazin-1-yl)pyrimidine dihydrochloride
CID 18364978
5,6,7,8-Tetrahydropyrido[4,3-d]pyrimidine dihydrochloride
CID 19883247
N,N-dimethyl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-amine
CID 20745808
2-(propan-2-yl)-5H,6H,7H,8H-pyrido[4,3-d]pyrimidine
CID 22308430
5H,6H,7H,8H-pyrido[4,3-d]pyrimidin-2-amine dihydrochloride
CID 45789615
2-methyl-5H,6H,7H,8H-pyrido[3,4-d]pyrimidine
CID 54592578

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine?
The IUPAC name of 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine (CID 103278300) is 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine.
What is the SMILES notation for 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine?
The canonical SMILES for 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine is CCc1cnc(N2CCNCC2)nc1C.
What is the InChIKey of 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine?
The InChIKey is GVWDFWNHPFXRQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4/c1-3-10-8-13-11(14-9(10)2)15-6-4-12-5-7-15/h8,12H,3-7H2,1-2H3.
What are the key properties of 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine?
5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine has a molecular weight of 206.29 g/mol, XLogP of 0.76, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-4-methyl-2-piperazin-1-ylpyrimidine is sourced from PubChem (CID 103278300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).