N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide

C13H26N2O2 — CID 114942625

IUPACN-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide
SMILESCCOC(C)(C)CNC(=O)C1CCC(C)NC1
InChIInChI=1S/C13H26N2O2/c1-5-17-13(3,4)9-15-12(16)11-7-6-10(2)14-8-11/h10-11,14H,5-9H2,1-4H3,(H,15,16)
InChIKeyGJUGIIFWKIHBIG-UHFFFAOYSA-N
MW242.36 g/mol
LogP1.31
Rot. Bonds5

About N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide

N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide (PubChem CID 114942625) has the molecular formula C13H26N2O2 and a molecular weight of 242.36 g/mol. Its IUPAC name is N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide
PubChem CID114942625
Molecular FormulaC13H26N2O2
Molecular Weight242.36 g/mol
Exact Mass242.20
IUPAC NameN-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide
SMILESCCOC(C)(C)CNC(=O)C1CCC(C)NC1
InChIInChI=1S/C13H26N2O2/c1-5-17-13(3,4)9-15-12(16)11-7-6-10(2)14-8-11/h10-11,14H,5-9H2,1-4H3,(H,15,16)
InChIKeyGJUGIIFWKIHBIG-UHFFFAOYSA-N
XLogP1.31
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.36
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide?
The IUPAC name of N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide (CID 114942625) is N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide.
What is the SMILES notation for N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide?
The canonical SMILES for N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide is CCOC(C)(C)CNC(=O)C1CCC(C)NC1.
What is the InChIKey of N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide?
The InChIKey is GJUGIIFWKIHBIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O2/c1-5-17-13(3,4)9-15-12(16)11-7-6-10(2)14-8-11/h10-11,14H,5-9H2,1-4H3,(H,15,16).
What are the key properties of N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide?
N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide has a molecular weight of 242.36 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-2-methylpropyl)-6-methylpiperidine-3-carboxamide is sourced from PubChem (CID 114942625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).