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

C10H16N4O — CID 15132535

IUPAC5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine
SMILESCOc1cnc(C)nc1N1CCNCC1
InChIInChI=1S/C10H16N4O/c1-8-12-7-9(15-2)10(13-8)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3
InChIKeySOQMLHXPSYXOKX-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.20
Rot. Bonds2

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

5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine (PubChem CID 15132535) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine.

Molecular Properties

Compound Name5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine
PubChem CID15132535
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine
SMILESCOc1cnc(C)nc1N1CCNCC1
InChIInChI=1S/C10H16N4O/c1-8-12-7-9(15-2)10(13-8)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3
InChIKeySOQMLHXPSYXOKX-UHFFFAOYSA-N
XLogP0.20
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-Methoxy-4-(4-methylpiperazin-1-yl)pyrimidin-2-amine
CID 25129175
4-N-butyl-5-propan-2-yloxypyrimidine-2,4-diamine
CID 70856469
4-Pyrimidinamine, 2,5-dimethoxy-
CID 250370
5-Methoxypyrimidin-4-amine
CID 817704
4-N-(2-cyclopropylethyl)-5-methoxypyrimidine-2,4-diamine
CID 70856123
4-N-butyl-5-propoxypyrimidine-2,4-diamine
CID 70856429
4-N-butyl-5-ethoxypyrimidine-2,4-diamine
CID 70856441
5-ethoxy-4-N-pentylpyrimidine-2,4-diamine
CID 70856447
5-methoxy-4-N-pentan-2-ylpyrimidine-2,4-diamine
CID 70856478
5-methoxy-4-N-prop-2-enylpyrimidine-2,4-diamine
CID 89037059
5-methoxy-4-N-(4,4,4-trifluorobutyl)pyrimidine-2,4-diamine
CID 89966608
1-(5-Hydroxy-2-pyrimidinyl)piperazine
CID 34180809

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine?
The IUPAC name of 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine (CID 15132535) is 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine.
What is the SMILES notation for 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine?
The canonical SMILES for 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine is COc1cnc(C)nc1N1CCNCC1.
What is the InChIKey of 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine?
The InChIKey is SOQMLHXPSYXOKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-8-12-7-9(15-2)10(13-8)14-5-3-11-4-6-14/h7,11H,3-6H2,1-2H3.
What are the key properties of 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine?
5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine has a molecular weight of 208.26 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-methyl-4-piperazin-1-ylpyrimidine is sourced from PubChem (CID 15132535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).