N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide

C14H23NO3 — CID 2836718

IUPACN,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCCN(CC)C(=O)C1CC(=O)OC12CCCCC2
InChIInChI=1S/C14H23NO3/c1-3-15(4-2)13(17)11-10-12(16)18-14(11)8-6-5-7-9-14/h11H,3-10H2,1-2H3
InChIKeyISQPZEASERVACR-UHFFFAOYSA-N
MW253.34 g/mol
LogP2.12
Rot. Bonds3

About N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide

N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide (PubChem CID 2836718) has the molecular formula C14H23NO3 and a molecular weight of 253.34 g/mol. Its IUPAC name is N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
PubChem CID2836718
Molecular FormulaC14H23NO3
Molecular Weight253.34 g/mol
Exact Mass253.17
IUPAC NameN,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCCN(CC)C(=O)C1CC(=O)OC12CCCCC2
InChIInChI=1S/C14H23NO3/c1-3-15(4-2)13(17)11-10-12(16)18-14(11)8-6-5-7-9-14/h11H,3-10H2,1-2H3
InChIKeyISQPZEASERVACR-UHFFFAOYSA-N
XLogP2.12
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.34
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide?
The IUPAC name of N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide (CID 2836718) is N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide is CCN(CC)C(=O)C1CC(=O)OC12CCCCC2.
What is the InChIKey of N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide?
The InChIKey is ISQPZEASERVACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO3/c1-3-15(4-2)13(17)11-10-12(16)18-14(11)8-6-5-7-9-14/h11H,3-10H2,1-2H3.
What are the key properties of N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide?
N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide has a molecular weight of 253.34 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-oxo-1-oxaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 2836718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).