2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine

C15H33N3 — CID 62773305

IUPAC2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
SMILESCC(C)CNCC(C)N1CCN(CC(C)C)CC1
InChIInChI=1S/C15H33N3/c1-13(2)10-16-11-15(5)18-8-6-17(7-9-18)12-14(3)4/h13-16H,6-12H2,1-5H3
InChIKeyXAJPLXAAWUURJL-UHFFFAOYSA-N
MW255.45 g/mol
LogP1.89
Rot. Bonds7

About 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine

2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine (PubChem CID 62773305) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine.

Molecular Properties

Compound Name2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
PubChem CID62773305
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC Name2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
SMILESCC(C)CNCC(C)N1CCN(CC(C)C)CC1
InChIInChI=1S/C15H33N3/c1-13(2)10-16-11-15(5)18-8-6-17(7-9-18)12-14(3)4/h13-16H,6-12H2,1-5H3
InChIKeyXAJPLXAAWUURJL-UHFFFAOYSA-N
XLogP1.89
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine 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

N-ethyl-2-[4-(2-methylpropyl)piperazin-1-yl]propan-1-amine
CID 62772925
N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
CID 62463018
N-[2-(1,1-dioxo-1,4-thiazinan-4-yl)propyl]-2-methylpropan-1-amine
CID 62433248
N-[2-(4-cyclopentylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
CID 62446554
N-ethyl-4-[4-(2-methylpropyl)piperazin-1-yl]pentan-1-amine
CID 62776961
3-[4-(2-methylpropyl)piperazin-1-yl]butan-1-amine
CID 62777232
4-[4-(2-methylpropyl)piperazin-1-yl]pentan-2-ol
CID 64720384
2-methyl-3-(4-methylpiperazin-1-yl)-N-(2-methylpropyl)propan-1-amine
CID 62438498
N-[2-(4-methoxypiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62420010
2-methyl-N-[2-(1,4-thiazepan-4-yl)propyl]propan-1-amine
CID 62412047
1-(ethylamino)-3-[4-(2-methylpropyl)piperazin-1-yl]propan-2-ol
CID 62775672
N,3-dimethyl-2-[4-(2-methylpropyl)piperazin-1-yl]butan-1-amine
CID 62776257

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine?
The IUPAC name of 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine (CID 62773305) is 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine.
What is the SMILES notation for 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine?
The canonical SMILES for 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine is CC(C)CNCC(C)N1CCN(CC(C)C)CC1.
What is the InChIKey of 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine?
The InChIKey is XAJPLXAAWUURJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-13(2)10-16-11-15(5)18-8-6-17(7-9-18)12-14(3)4/h13-16H,6-12H2,1-5H3.
What are the key properties of 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine?
2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine has a molecular weight of 255.45 g/mol, XLogP of 1.89, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine is sourced from PubChem (CID 62773305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).