N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine

C13H26N2 — CID 784138

IUPACN,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine
SMILESC=C(C)CN(CC)C1CCN(CC)CC1
InChIInChI=1S/C13H26N2/c1-5-14-9-7-13(8-10-14)15(6-2)11-12(3)4/h13H,3,5-11H2,1-2,4H3
InChIKeyYOFBLBASFHZUBM-UHFFFAOYSA-N
MW210.36 g/mol
LogP2.37
Rot. Bonds5

About N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine

N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine (PubChem CID 784138) has the molecular formula C13H26N2 and a molecular weight of 210.36 g/mol. Its IUPAC name is N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine.

Molecular Properties

Compound NameN,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine
PubChem CID784138
Molecular FormulaC13H26N2
Molecular Weight210.36 g/mol
Exact Mass210.21
IUPAC NameN,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine
SMILESC=C(C)CN(CC)C1CCN(CC)CC1
InChIInChI=1S/C13H26N2/c1-5-14-9-7-13(8-10-14)15(6-2)11-12(3)4/h13H,3,5-11H2,1-2,4H3
InChIKeyYOFBLBASFHZUBM-UHFFFAOYSA-N
XLogP2.37
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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 N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine?
The IUPAC name of N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine (CID 784138) is N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine.
What is the SMILES notation for N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine?
The canonical SMILES for N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine is C=C(C)CN(CC)C1CCN(CC)CC1.
What is the InChIKey of N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine?
The InChIKey is YOFBLBASFHZUBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2/c1-5-14-9-7-13(8-10-14)15(6-2)11-12(3)4/h13H,3,5-11H2,1-2,4H3.
What are the key properties of N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine?
N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine has a molecular weight of 210.36 g/mol, XLogP of 2.37, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-diethyl-N-(2-methylprop-2-enyl)piperidin-4-amine is sourced from PubChem (CID 784138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).