4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine

C15H26N4 — CID 64945783

IUPAC4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
SMILESCCCC1CN(Cc2ccnc(C)n2)C(CC)CN1
InChIInChI=1S/C15H26N4/c1-4-6-13-10-19(15(5-2)9-17-13)11-14-7-8-16-12(3)18-14/h7-8,13,15,17H,4-6,9-11H2,1-3H3
InChIKeyPWXHRDOEIDYWJA-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.14
Rot. Bonds5

About 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine

4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine (PubChem CID 64945783) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine.

Molecular Properties

Compound Name4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
PubChem CID64945783
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine
SMILESCCCC1CN(Cc2ccnc(C)n2)C(CC)CN1
InChIInChI=1S/C15H26N4/c1-4-6-13-10-19(15(5-2)9-17-13)11-14-7-8-16-12(3)18-14/h7-8,13,15,17H,4-6,9-11H2,1-3H3
InChIKeyPWXHRDOEIDYWJA-UHFFFAOYSA-N
XLogP2.14
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine?
The IUPAC name of 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine (CID 64945783) is 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine.
What is the SMILES notation for 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine?
The canonical SMILES for 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine is CCCC1CN(Cc2ccnc(C)n2)C(CC)CN1.
What is the InChIKey of 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine?
The InChIKey is PWXHRDOEIDYWJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-6-13-10-19(15(5-2)9-17-13)11-14-7-8-16-12(3)18-14/h7-8,13,15,17H,4-6,9-11H2,1-3H3.
What are the key properties of 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine?
4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine has a molecular weight of 262.40 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-ethyl-5-propylpiperazin-1-yl)methyl]-2-methylpyrimidine is sourced from PubChem (CID 64945783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).