N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide

C16H30N2O2 — CID 119344181

IUPACN-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide
SMILESCCOC1CC(NC(=O)C2CCCNC2)C1(CC)CC
InChIInChI=1S/C16H30N2O2/c1-4-16(5-2)13(10-14(16)20-6-3)18-15(19)12-8-7-9-17-11-12/h12-14,17H,4-11H2,1-3H3,(H,18,19)
InChIKeyBYWGWBXTQGEVFB-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.09
Rot. Bonds6

About N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide

N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide (PubChem CID 119344181) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide
PubChem CID119344181
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC NameN-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide
SMILESCCOC1CC(NC(=O)C2CCCNC2)C1(CC)CC
InChIInChI=1S/C16H30N2O2/c1-4-16(5-2)13(10-14(16)20-6-3)18-15(19)12-8-7-9-17-11-12/h12-14,17H,4-11H2,1-3H3,(H,18,19)
InChIKeyBYWGWBXTQGEVFB-UHFFFAOYSA-N
XLogP2.09
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide?
The IUPAC name of N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide (CID 119344181) is N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide?
The canonical SMILES for N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide is CCOC1CC(NC(=O)C2CCCNC2)C1(CC)CC.
What is the InChIKey of N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide?
The InChIKey is BYWGWBXTQGEVFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-4-16(5-2)13(10-14(16)20-6-3)18-15(19)12-8-7-9-17-11-12/h12-14,17H,4-11H2,1-3H3,(H,18,19).
What are the key properties of N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide?
N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide has a molecular weight of 282.43 g/mol, XLogP of 2.09, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2,2-diethylcyclobutyl)piperidine-3-carboxamide is sourced from PubChem (CID 119344181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).