1-(2,2-dimethylpropyl)-4-methylpiperazine

C10H22N2 — CID 12566800

IUPAC1-(2,2-dimethylpropyl)-4-methylpiperazine
SMILESCN1CCN(CC(C)(C)C)CC1
InChIInChI=1S/C10H22N2/c1-10(2,3)9-12-7-5-11(4)6-8-12/h5-9H2,1-4H3
InChIKeyAJGLFRJMVRQXSZ-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.28
Rot. Bonds1

About 1-(2,2-dimethylpropyl)-4-methylpiperazine

1-(2,2-dimethylpropyl)-4-methylpiperazine (PubChem CID 12566800) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 1-(2,2-dimethylpropyl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(2,2-dimethylpropyl)-4-methylpiperazine
PubChem CID12566800
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name1-(2,2-dimethylpropyl)-4-methylpiperazine
SMILESCN1CCN(CC(C)(C)C)CC1
InChIInChI=1S/C10H22N2/c1-10(2,3)9-12-7-5-11(4)6-8-12/h5-9H2,1-4H3
InChIKeyAJGLFRJMVRQXSZ-UHFFFAOYSA-N
XLogP1.28
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(2,2-dimethylpropyl)-4-methylpiperazine 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

1-(2,2-dimethylpropyl)-4-methylpiperazine;1-(2,2-dimethylpropyl)-4-methylpiperidine
CID 157215210
1-(2,2-dimethylpropyl)-4-methylpiperazine;4-(2,2-dimethylpropyl)morpholine;methane
CID 162058346
1-methyl-4-(2,2,4,4-tetramethylpentyl)piperazine
CID 163906125
1-cyclopropyl-4-(2,2-dimethylpropyl)piperazine;1-(2,2-dimethylpropyl)-4-(1-methylpiperidin-4-yl)piperazine
CID 160625863
1-methyl-4-(2,2,2-trifluoroethyl)piperazine
CID 23236212
1-(2,2-dimethylpropyl)azocane
CID 131007399
1-(3,3-dimethylbutyl)-4-methylpiperazine;ethane
CID 145236948
N-tert-butyl-2-methyl-1-(4-methylpiperazin-1-yl)propan-2-amine
CID 166832141
1-(2,2-dimethylpropyl)piperidine;ethane
CID 162156975
1-amino-2-methyl-3-(4-methylpiperazin-1-yl)propan-2-ol
CID 64819199
3,3-dimethyl-4-(4-methylpiperazin-1-yl)butan-2-ol
CID 66452170
4-(2,2-dimethylpropyl)-N,N-dimethylpiperazin-1-amine
CID 122427918

Frequently Asked Questions

What is the IUPAC name of 1-(2,2-dimethylpropyl)-4-methylpiperazine?
The IUPAC name of 1-(2,2-dimethylpropyl)-4-methylpiperazine (CID 12566800) is 1-(2,2-dimethylpropyl)-4-methylpiperazine.
What is the SMILES notation for 1-(2,2-dimethylpropyl)-4-methylpiperazine?
The canonical SMILES for 1-(2,2-dimethylpropyl)-4-methylpiperazine is CN1CCN(CC(C)(C)C)CC1.
What is the InChIKey of 1-(2,2-dimethylpropyl)-4-methylpiperazine?
The InChIKey is AJGLFRJMVRQXSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-10(2,3)9-12-7-5-11(4)6-8-12/h5-9H2,1-4H3.
What are the key properties of 1-(2,2-dimethylpropyl)-4-methylpiperazine?
1-(2,2-dimethylpropyl)-4-methylpiperazine has a molecular weight of 170.30 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2-dimethylpropyl)-4-methylpiperazine is sourced from PubChem (CID 12566800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).