N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide

C16H30N2O — CID 762851

IUPACN-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide
SMILESC=C(C)CN(CC)C(=O)C1CCN(CC(C)C)CC1
InChIInChI=1S/C16H30N2O/c1-6-18(12-14(4)5)16(19)15-7-9-17(10-8-15)11-13(2)3/h13,15H,4,6-12H2,1-3,5H3
InChIKeyVLACZINVFZEXLE-UHFFFAOYSA-N
MW266.43 g/mol
LogP2.78
Rot. Bonds6

About N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide

N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide (PubChem CID 762851) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide
PubChem CID762851
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC NameN-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide
SMILESC=C(C)CN(CC)C(=O)C1CCN(CC(C)C)CC1
InChIInChI=1S/C16H30N2O/c1-6-18(12-14(4)5)16(19)15-7-9-17(10-8-15)11-13(2)3/h13,15H,4,6-12H2,1-3,5H3
InChIKeyVLACZINVFZEXLE-UHFFFAOYSA-N
XLogP2.78
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 52.78
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-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide?
The IUPAC name of N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide (CID 762851) is N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide?
The canonical SMILES for N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide is C=C(C)CN(CC)C(=O)C1CCN(CC(C)C)CC1.
What is the InChIKey of N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide?
The InChIKey is VLACZINVFZEXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-6-18(12-14(4)5)16(19)15-7-9-17(10-8-15)11-13(2)3/h13,15H,4,6-12H2,1-3,5H3.
What are the key properties of N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide?
N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide has a molecular weight of 266.43 g/mol, XLogP of 2.78, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylprop-2-enyl)-1-(2-methylpropyl)piperidine-4-carboxamide is sourced from PubChem (CID 762851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).