N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine

C15H33N3 — CID 62463018

IUPACN-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(C)N1CCN(C(C)(C)C)CC1
InChIInChI=1S/C15H33N3/c1-13(2)11-16-12-14(3)17-7-9-18(10-8-17)15(4,5)6/h13-14,16H,7-12H2,1-6H3
InChIKeyZNJCHPFNSCLVGT-UHFFFAOYSA-N
MW255.45 g/mol
LogP2.04
Rot. Bonds5

About N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine

N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine (PubChem CID 62463018) has the molecular formula C15H33N3 and a molecular weight of 255.45 g/mol. Its IUPAC name is N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine.

Molecular Properties

Compound NameN-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
PubChem CID62463018
Molecular FormulaC15H33N3
Molecular Weight255.45 g/mol
Exact Mass255.27
IUPAC NameN-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine
SMILESCC(C)CNCC(C)N1CCN(C(C)(C)C)CC1
InChIInChI=1S/C15H33N3/c1-13(2)11-16-12-14(3)17-7-9-18(10-8-17)15(4,5)6/h13-14,16H,7-12H2,1-6H3
InChIKeyZNJCHPFNSCLVGT-UHFFFAOYSA-N
XLogP2.04
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.45
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-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

2-(4-tert-butylpiperazin-1-yl)-N-(2-methoxyethyl)propan-1-amine
CID 62569252
2-methyl-N-[2-[4-(2-methylpropyl)piperazin-1-yl]propyl]propan-1-amine
CID 62773305
N-[2-(4-tert-butylpiperazin-1-yl)propyl]cyclopropanamine
CID 55072104
N-[2-(4-tert-butylpiperazin-1-yl)ethyl]-2-methylpropan-1-amine
CID 62463178
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
2-methyl-N-[2-(1,4-thiazepan-4-yl)propyl]propan-1-amine
CID 62412047
N-[2-(4-methoxypiperidin-1-yl)propyl]-2-methylpropan-1-amine
CID 62420010
5-(4-tert-butylpiperazin-1-yl)-2-methyl-N-propan-2-ylhexan-2-amine
CID 167254513
4-(4-tert-butylpiperazin-1-yl)-N-propan-2-ylpentan-1-amine
CID 62463195
4-(4-tert-butylpiperazin-1-yl)pentan-1-amine
CID 62463192
N-[2-[4-[(dimethylamino)methyl]piperidin-1-yl]propyl]-2-methylpropan-1-amine
CID 55073601

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine?
The IUPAC name of N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine (CID 62463018) is N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine.
What is the SMILES notation for N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine?
The canonical SMILES for N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine is CC(C)CNCC(C)N1CCN(C(C)(C)C)CC1.
What is the InChIKey of N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine?
The InChIKey is ZNJCHPFNSCLVGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3/c1-13(2)11-16-12-14(3)17-7-9-18(10-8-17)15(4,5)6/h13-14,16H,7-12H2,1-6H3.
What are the key properties of N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine?
N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine has a molecular weight of 255.45 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-tert-butylpiperazin-1-yl)propyl]-2-methylpropan-1-amine is sourced from PubChem (CID 62463018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).