N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide

C13H21NO4 — CID 47249813

IUPACN-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide
SMILESO=C(NC1CCC2(CC1)OCCO2)C1CCCO1
InChIInChI=1S/C13H21NO4/c15-12(11-2-1-7-16-11)14-10-3-5-13(6-4-10)17-8-9-18-13/h10-11H,1-9H2,(H,14,15)
InChIKeyRLWNDXMAXLDGJJ-UHFFFAOYSA-N
MW255.31 g/mol
LogP0.97
Rot. Bonds2

About N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide

N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide (PubChem CID 47249813) has the molecular formula C13H21NO4 and a molecular weight of 255.31 g/mol. Its IUPAC name is N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide
PubChem CID47249813
Molecular FormulaC13H21NO4
Molecular Weight255.31 g/mol
Exact Mass255.15
IUPAC NameN-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide
SMILESO=C(NC1CCC2(CC1)OCCO2)C1CCCO1
InChIInChI=1S/C13H21NO4/c15-12(11-2-1-7-16-11)14-10-3-5-13(6-4-10)17-8-9-18-13/h10-11H,1-9H2,(H,14,15)
InChIKeyRLWNDXMAXLDGJJ-UHFFFAOYSA-N
XLogP0.97
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.31
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-(Oxolane-2-carbonylamino)cyclohexyl] oxolane-2-carboxylate
CID 42956116
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methoxyacetamide
CID 47249817
N-(1,4-dioxaspiro[4.5]decan-8-yl)-1,4-dioxane-2-carboxamide
CID 47249858
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methoxypropanamide
CID 47308334
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-propan-2-yloxyacetamide
CID 48143654
N-[2-(4-aminocyclohexyl)oxyethyl]oxolane-2-carboxamide
CID 55251216
N-[3-(4-aminocyclohexyl)oxypropyl]oxolane-2-carboxamide
CID 55251927
N-[2-methyl-3-(2-methyl-1,3-dioxolan-2-yl)propyl]oxolane-2-carboxamide
CID 60340662
N-(1,4-dioxaspiro[4.5]decan-8-yl)-N-methyloxolane-2-carboxamide
CID 79111397
N-(1,4-dioxaspiro[4.5]decan-8-yl)oxane-2-carboxamide
CID 79111754
N-(1,4-dioxaspiro[4.5]decan-8-yl)-N,2-dimethyloxolane-2-carboxamide
CID 80181541
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2-methyloxolane-2-carboxamide
CID 80182568

Frequently Asked Questions

What is the IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide?
The IUPAC name of N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide (CID 47249813) is N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide.
What is the SMILES notation for N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide?
The canonical SMILES for N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide is O=C(NC1CCC2(CC1)OCCO2)C1CCCO1.
What is the InChIKey of N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide?
The InChIKey is RLWNDXMAXLDGJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO4/c15-12(11-2-1-7-16-11)14-10-3-5-13(6-4-10)17-8-9-18-13/h10-11H,1-9H2,(H,14,15).
What are the key properties of N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide?
N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide has a molecular weight of 255.31 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,4-dioxaspiro[4.5]decan-8-yl)oxolane-2-carboxamide is sourced from PubChem (CID 47249813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).