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

C13H25N — CID 155706752

IUPAC1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine
SMILESC=C(C)CN1CCC(CC(C)C)CC1
InChIInChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h11,13H,3,5-10H2,1-2,4H3
InChIKeyRTFHANMMOLIITB-UHFFFAOYSA-N
MW195.35 g/mol
LogP3.32
Rot. Bonds4

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

1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine (PubChem CID 155706752) has the molecular formula C13H25N and a molecular weight of 195.35 g/mol. Its IUPAC name is 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine.

Molecular Properties

Compound Name1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine
PubChem CID155706752
Molecular FormulaC13H25N
Molecular Weight195.35 g/mol
Exact Mass195.20
IUPAC Name1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine
SMILESC=C(C)CN1CCC(CC(C)C)CC1
InChIInChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h11,13H,3,5-10H2,1-2,4H3
InChIKeyRTFHANMMOLIITB-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'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine?
The IUPAC name of 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine (CID 155706752) is 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine.
What is the SMILES notation for 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine?
The canonical SMILES for 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine is C=C(C)CN1CCC(CC(C)C)CC1.
What is the InChIKey of 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine?
The InChIKey is RTFHANMMOLIITB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N/c1-11(2)9-13-5-7-14(8-6-13)10-12(3)4/h11,13H,3,5-10H2,1-2,4H3.
What are the key properties of 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine?
1-(2-methylprop-2-enyl)-4-(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 1-(2-methylprop-2-enyl)-4-(2-methylpropyl)piperidine is sourced from PubChem (CID 155706752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).