4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine

C13H25N — CID 126612510

IUPAC4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine
SMILESC=C(C)CC1CCN(CC(C)C)CC1
InChIInChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h12-13H,1,5-10H2,2-4H3
InChIKeyMPIDUFPRIYDJKI-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.32
Rot. Bonds4

About 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine

4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine (PubChem CID 126612510) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine
PubChem CID126612510
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine
SMILESC=C(C)CC1CCN(CC(C)C)CC1
InChIInChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h12-13H,1,5-10H2,2-4H3
InChIKeyMPIDUFPRIYDJKI-UHFFFAOYSA-N
XLogP3.32
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.35
LogP ≤ 53.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine 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

3-methyl-1-[1-(2-methylpropyl)piperidin-4-yl]butan-2-one
CID 153390625
N-[[1-(2-methylpropyl)piperidin-4-yl]methyl]propan-1-amine
CID 62593266
1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine
CID 155706752
2,2,2-trifluoro-N-[[1-(2-methylpropyl)piperidin-4-yl]methyl]ethanamine
CID 83983142
2-methyl-1-[1-(2-methylpropyl)piperidin-4-yl]propan-1-one
CID 176724060
4-(2,5-dimethylheptyl)-1-(2-methylpropyl)piperidine
CID 167107327
4-chloro-1-(2-methylpropyl)piperidine
CID 63389166
4-ethenyl-1-(2-methylpropyl)piperidine
CID 138457613
1-cyclopropyl-2-[(3S)-1-(2-methylpropyl)pyrrolidin-3-yl]ethanone
CID 165387278
2-[1-(2-methylpropyl)pyrrolidin-3-yl]ethanol
CID 83981105
7-[[1-(2-methylpropyl)piperidin-4-yl]methyl]-2-prop-1-en-2-yloxy-7-azaspiro[3.5]nonane
CID 155036623
N-buta-1,3-dien-2-yl-1-(2-methylpropyl)piperidin-4-amine
CID 144655866

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine?
The IUPAC name of 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine (CID 126612510) is 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine.
What is the SMILES notation for 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine?
The canonical SMILES for 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine is C=C(C)CC1CCN(CC(C)C)CC1.
What is the InChIKey of 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine?
The InChIKey is MPIDUFPRIYDJKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h12-13H,1,5-10H2,2-4H3.
What are the key properties of 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine?
4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine has a molecular weight of 195.35 g/mol, XLogP of 3.32, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine is sourced from PubChem (CID 126612510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).