1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine

C14H27N5 — CID 106552617

IUPAC1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine
SMILESCCc1cn(CC)c(N(C)CCN2CCNCC2)n1
InChIInChI=1S/C14H27N5/c1-4-13-12-19(5-2)14(16-13)17(3)10-11-18-8-6-15-7-9-18/h12,15H,4-11H2,1-3H3
InChIKeyYFTRFVRNJGJCFV-UHFFFAOYSA-N
MW265.40 g/mol
LogP0.81
Rot. Bonds6

About 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine

1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine (PubChem CID 106552617) has the molecular formula C14H27N5 and a molecular weight of 265.40 g/mol. Its IUPAC name is 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine.

Molecular Properties

Compound Name1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine
PubChem CID106552617
Molecular FormulaC14H27N5
Molecular Weight265.40 g/mol
Exact Mass265.23
IUPAC Name1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine
SMILESCCc1cn(CC)c(N(C)CCN2CCNCC2)n1
InChIInChI=1S/C14H27N5/c1-4-13-12-19(5-2)14(16-13)17(3)10-11-18-8-6-15-7-9-18/h12,15H,4-11H2,1-3H3
InChIKeyYFTRFVRNJGJCFV-UHFFFAOYSA-N
XLogP0.81
TPSA36.33 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine?
The IUPAC name of 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine (CID 106552617) is 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine.
What is the SMILES notation for 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine?
The canonical SMILES for 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine is CCc1cn(CC)c(N(C)CCN2CCNCC2)n1.
What is the InChIKey of 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine?
The InChIKey is YFTRFVRNJGJCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N5/c1-4-13-12-19(5-2)14(16-13)17(3)10-11-18-8-6-15-7-9-18/h12,15H,4-11H2,1-3H3.
What are the key properties of 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine?
1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine has a molecular weight of 265.40 g/mol, XLogP of 0.81, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-diethyl-N-methyl-N-(2-piperazin-1-ylethyl)imidazol-2-amine is sourced from PubChem (CID 106552617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).