2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine

C10H23N3 — CID 4742453

IUPAC2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
SMILESCC(C)CN1CCN(CCN)CC1
InChIInChI=1S/C10H23N3/c1-10(2)9-13-7-5-12(4-3-11)6-8-13/h10H,3-9,11H2,1-2H3
InChIKeyTXEIWRZSXRAGMY-UHFFFAOYSA-N
MW185.31 g/mol
LogP0.22
Rot. Bonds4

About 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine

2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine (PubChem CID 4742453) has the molecular formula C10H23N3 and a molecular weight of 185.31 g/mol. Its IUPAC name is 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
PubChem CID4742453
Molecular FormulaC10H23N3
Molecular Weight185.31 g/mol
Exact Mass185.19
IUPAC Name2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine
SMILESCC(C)CN1CCN(CCN)CC1
InChIInChI=1S/C10H23N3/c1-10(2)9-13-7-5-12(4-3-11)6-8-13/h10H,3-9,11H2,1-2H3
InChIKeyTXEIWRZSXRAGMY-UHFFFAOYSA-N
XLogP0.22
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine with MolForge

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

Launch Full Analysis

Related Compounds

2-[4-(4-methylpentyl)piperazin-1-yl]ethanamine
CID 83155367
1-methyl-4-(2-methylpropyl)piperazine
CID 20562082
1-(4-methylpentyl)-4-(2-methylpropyl)piperazine
CID 21131473
4-[2-[4-(2-methylpropyl)piperazin-1-yl]ethyl]morpholine
CID 91228276
2-ethyl-4-[4-(2-methylpropyl)piperazin-1-yl]butan-1-amine
CID 81079096
3-[4-(2-methylpropyl)piperazin-1-yl]butan-1-amine
CID 62777232
2-[4-(2-aminoethyl)piperazin-1-yl]propanal
CID 174502098
2-[4-[2-(2-methylpropoxy)ethyl]piperazin-1-yl]ethanamine
CID 106450826
2-[4-[2-(4-methylpiperazin-1-yl)ethyl]piperazin-1-yl]ethanamine
CID 82890041
4-[4-(2-methylpropyl)piperazin-1-yl]butan-1-ol
CID 62777800
[4-(2-methylpropyl)piperazin-1-yl]methanol
CID 58575664
N-methyl-3-[4-(2-methylpropyl)piperazin-1-yl]propan-1-amine
CID 62775254

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine (CID 4742453) is 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine is CC(C)CN1CCN(CCN)CC1.
What is the InChIKey of 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine?
The InChIKey is TXEIWRZSXRAGMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3/c1-10(2)9-13-7-5-12(4-3-11)6-8-13/h10H,3-9,11H2,1-2H3.
What are the key properties of 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine?
2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine has a molecular weight of 185.31 g/mol, XLogP of 0.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-methylpropyl)piperazin-1-yl]ethanamine is sourced from PubChem (CID 4742453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).