2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide

C16H27NO3 — CID 2920750

IUPAC2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCC(C)N(C(=O)C1CC(=O)OC12CCCCC2)C(C)C
InChIInChI=1S/C16H27NO3/c1-11(2)17(12(3)4)15(19)13-10-14(18)20-16(13)8-6-5-7-9-16/h11-13H,5-10H2,1-4H3
InChIKeyRWJQUBFLZXJGIU-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.90
Rot. Bonds3

About 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide

2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide (PubChem CID 2920750) has the molecular formula C16H27NO3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide
PubChem CID2920750
Molecular FormulaC16H27NO3
Molecular Weight281.40 g/mol
Exact Mass281.20
IUPAC Name2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCC(C)N(C(=O)C1CC(=O)OC12CCCCC2)C(C)C
InChIInChI=1S/C16H27NO3/c1-11(2)17(12(3)4)15(19)13-10-14(18)20-16(13)8-6-5-7-9-16/h11-13H,5-10H2,1-4H3
InChIKeyRWJQUBFLZXJGIU-UHFFFAOYSA-N
XLogP2.90
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide?
The IUPAC name of 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide (CID 2920750) is 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide is CC(C)N(C(=O)C1CC(=O)OC12CCCCC2)C(C)C.
What is the InChIKey of 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide?
The InChIKey is RWJQUBFLZXJGIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3/c1-11(2)17(12(3)4)15(19)13-10-14(18)20-16(13)8-6-5-7-9-16/h11-13H,5-10H2,1-4H3.
What are the key properties of 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide?
2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N,N-di(propan-2-yl)-1-oxaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 2920750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).