N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide

C17H32N2O2 — CID 114429439

IUPACN-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CCOC(CC)(CC)C2)C1
InChIInChI=1S/C17H32N2O2/c1-4-13-7-9-18-15(11-13)16(20)19-14-8-10-21-17(5-2,6-3)12-14/h13-15,18H,4-12H2,1-3H3,(H,19,20)
InChIKeyQEAGFRDQJVTZOJ-UHFFFAOYSA-N
MW296.45 g/mol
LogP2.62
Rot. Bonds5

About N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide

N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide (PubChem CID 114429439) has the molecular formula C17H32N2O2 and a molecular weight of 296.45 g/mol. Its IUPAC name is N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide.

Molecular Properties

Compound NameN-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
PubChem CID114429439
Molecular FormulaC17H32N2O2
Molecular Weight296.45 g/mol
Exact Mass296.25
IUPAC NameN-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide
SMILESCCC1CCNC(C(=O)NC2CCOC(CC)(CC)C2)C1
InChIInChI=1S/C17H32N2O2/c1-4-13-7-9-18-15(11-13)16(20)19-14-8-10-21-17(5-2,6-3)12-14/h13-15,18H,4-12H2,1-3H3,(H,19,20)
InChIKeyQEAGFRDQJVTZOJ-UHFFFAOYSA-N
XLogP2.62
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.45
LogP ≤ 52.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,2-diethyloxan-4-yl)-4-methylpiperidine-2-carboxamide
CID 114424424
(2R)-N-(2,2-diethyloxan-4-yl)pyrrolidine-2-carboxamide
CID 104901402
4-ethyl-N-(oxolan-3-yl)piperidine-2-carboxamide
CID 114429328
N-(3,5-dimethylcyclohexyl)-4-ethylpiperidine-2-carboxamide
CID 114429133
N-(2,2-diethyloxan-4-yl)-3-methylpyrrolidine-2-carboxamide
CID 102779942
N-(2,2-diethyloxan-4-yl)-2-oxo-2-piperazin-1-ylacetamide
CID 83035026
4-ethyl-N-(1-methyl-6-oxopiperidin-3-yl)piperidine-2-carboxamide
CID 114429128
4-ethyl-N-(3-hydroxy-2,2-dimethylcyclobutyl)piperidine-2-carboxamide
CID 114629713
4-amino-N-(2,2-diethyloxan-4-yl)cyclopent-2-ene-1-carboxamide
CID 83029363
2-amino-N-(2,2-diethyloxan-4-yl)-5-methylcyclohexane-1-carboxamide
CID 83035895
N-(2,2-diethyloxan-4-yl)prop-2-enamide
CID 83032720
2-amino-N-(2,2-diethyloxan-4-yl)-3,3-dimethylbutanamide
CID 112555896

Frequently Asked Questions

What is the IUPAC name of N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide?
The IUPAC name of N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide (CID 114429439) is N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide.
What is the SMILES notation for N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide?
The canonical SMILES for N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide is CCC1CCNC(C(=O)NC2CCOC(CC)(CC)C2)C1.
What is the InChIKey of N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide?
The InChIKey is QEAGFRDQJVTZOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O2/c1-4-13-7-9-18-15(11-13)16(20)19-14-8-10-21-17(5-2,6-3)12-14/h13-15,18H,4-12H2,1-3H3,(H,19,20).
What are the key properties of N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide?
N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide has a molecular weight of 296.45 g/mol, XLogP of 2.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-diethyloxan-4-yl)-4-ethylpiperidine-2-carboxamide is sourced from PubChem (CID 114429439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).