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

C16H27NO3 — CID 2920370

IUPAC2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CC(=O)OC12CCCCC2
InChIInChI=1S/C16H27NO3/c1-3-10-17(11-4-2)15(19)13-12-14(18)20-16(13)8-6-5-7-9-16/h13H,3-12H2,1-2H3
InChIKeyYHFBJLQRSOSUBY-UHFFFAOYSA-N
MW281.40 g/mol
LogP2.90
Rot. Bonds5

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

2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide (PubChem CID 2920370) has the molecular formula C16H27NO3 and a molecular weight of 281.40 g/mol. Its IUPAC name is 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide.

Molecular Properties

Compound Name2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide
PubChem CID2920370
Molecular FormulaC16H27NO3
Molecular Weight281.40 g/mol
Exact Mass281.20
IUPAC Name2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide
SMILESCCCN(CCC)C(=O)C1CC(=O)OC12CCCCC2
InChIInChI=1S/C16H27NO3/c1-3-10-17(11-4-2)15(19)13-12-14(18)20-16(13)8-6-5-7-9-16/h13H,3-12H2,1-2H3
InChIKeyYHFBJLQRSOSUBY-UHFFFAOYSA-N
XLogP2.90
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
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-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide?
The IUPAC name of 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide (CID 2920370) is 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide.
What is the SMILES notation for 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide?
The canonical SMILES for 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide is CCCN(CCC)C(=O)C1CC(=O)OC12CCCCC2.
What is the InChIKey of 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide?
The InChIKey is YHFBJLQRSOSUBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO3/c1-3-10-17(11-4-2)15(19)13-12-14(18)20-16(13)8-6-5-7-9-16/h13H,3-12H2,1-2H3.
What are the key properties of 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide?
2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide has a molecular weight of 281.40 g/mol, XLogP of 2.90, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N,N-dipropyl-1-oxaspiro[4.5]decane-4-carboxamide is sourced from PubChem (CID 2920370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).