N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide

C13H21NO3 — CID 122276279

IUPACN-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide
SMILESO=C(NC1CCC12CCOCC2)C1CCCO1
InChIInChI=1S/C13H21NO3/c15-12(10-2-1-7-17-10)14-11-3-4-13(11)5-8-16-9-6-13/h10-11H,1-9H2,(H,14,15)
InChIKeyUHWXIDIEFOORPS-UHFFFAOYSA-N
MW239.31 g/mol
LogP1.24
Rot. Bonds2

About N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide

N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide (PubChem CID 122276279) has the molecular formula C13H21NO3 and a molecular weight of 239.31 g/mol. Its IUPAC name is N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide
PubChem CID122276279
Molecular FormulaC13H21NO3
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC NameN-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide
SMILESO=C(NC1CCC12CCOCC2)C1CCCO1
InChIInChI=1S/C13H21NO3/c15-12(10-2-1-7-17-10)14-11-3-4-13(11)5-8-16-9-6-13/h10-11H,1-9H2,(H,14,15)
InChIKeyUHWXIDIEFOORPS-UHFFFAOYSA-N
XLogP1.24
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(oxan-4-yl)oxolane-2-carboxamide
CID 110726803
(2R)-N-cyclopropyloxolane-2-carboxamide
CID 40569533
(2R)-N-[4-(hydroxymethyl)oxan-4-yl]oxolane-2-carboxamide
CID 104630614
(2S)-N-cyclopentyloxolane-2-carboxamide
CID 7368997
(2R)-N-cyclopentyloxolane-2-carboxamide
CID 7368998
(2S)-N-(azetidin-3-yl)oxolane-2-carboxamide
CID 104856358
N-(3-amino-2,2-dimethylcyclobutyl)oxolane-2-carboxamide
CID 114632350
4-methyl-N-(7-oxaspiro[3.5]nonan-3-yl)piperazine-1-carboxamide
CID 122276427
1-methylsulfonyl-N-(7-oxaspiro[3.5]nonan-3-yl)piperidine-4-carboxamide
CID 122276202
4-fluoro-N-(7-oxaspiro[3.5]nonan-3-yl)benzamide
CID 122276126
(2S)-N-[4-(methylamino)cyclohexyl]oxolane-2-carboxamide
CID 93256529
(2R)-N-[4-(methylamino)cyclohexyl]oxolane-2-carboxamide
CID 93256530

Frequently Asked Questions

What is the IUPAC name of N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide?
The IUPAC name of N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide (CID 122276279) is N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide is O=C(NC1CCC12CCOCC2)C1CCCO1.
What is the InChIKey of N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide?
The InChIKey is UHWXIDIEFOORPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO3/c15-12(10-2-1-7-17-10)14-11-3-4-13(11)5-8-16-9-6-13/h10-11H,1-9H2,(H,14,15).
What are the key properties of N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide?
N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide has a molecular weight of 239.31 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-oxaspiro[3.5]nonan-3-yl)oxolane-2-carboxamide is sourced from PubChem (CID 122276279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).