2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine

C14H24N4O — CID 112634964

IUPAC2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine
SMILESCCC1CN(c2nc(C)cc(OC)n2)C(CC)CN1
InChIInChI=1S/C14H24N4O/c1-5-11-9-18(12(6-2)8-15-11)14-16-10(3)7-13(17-14)19-4/h7,11-12,15H,5-6,8-9H2,1-4H3
InChIKeyQBHZOYVRWWWNOO-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.76
Rot. Bonds4

About 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine

2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine (PubChem CID 112634964) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine.

Molecular Properties

Compound Name2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine
PubChem CID112634964
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine
SMILESCCC1CN(c2nc(C)cc(OC)n2)C(CC)CN1
InChIInChI=1S/C14H24N4O/c1-5-11-9-18(12(6-2)8-15-11)14-16-10(3)7-13(17-14)19-4/h7,11-12,15H,5-6,8-9H2,1-4H3
InChIKeyQBHZOYVRWWWNOO-UHFFFAOYSA-N
XLogP1.76
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine?
The IUPAC name of 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine (CID 112634964) is 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine.
What is the SMILES notation for 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine?
The canonical SMILES for 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine is CCC1CN(c2nc(C)cc(OC)n2)C(CC)CN1.
What is the InChIKey of 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine?
The InChIKey is QBHZOYVRWWWNOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c1-5-11-9-18(12(6-2)8-15-11)14-16-10(3)7-13(17-14)19-4/h7,11-12,15H,5-6,8-9H2,1-4H3.
What are the key properties of 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine?
2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine has a molecular weight of 264.37 g/mol, XLogP of 1.76, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-diethylpiperazin-1-yl)-4-methoxy-6-methylpyrimidine is sourced from PubChem (CID 112634964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).