2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide

C13H21NO3 — CID 112729642

IUPAC2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
SMILESO=C(CC1CC1)NC1CCC2(CC1)OCCO2
InChIInChI=1S/C13H21NO3/c15-12(9-10-1-2-10)14-11-3-5-13(6-4-11)16-7-8-17-13/h10-11H,1-9H2,(H,14,15)
InChIKeyWLGHAMIQZOKFMT-UHFFFAOYSA-N
MW239.31 g/mol
LogP1.59
Rot. Bonds3

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

2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide (PubChem CID 112729642) has the molecular formula C13H21NO3 and a molecular weight of 239.31 g/mol. Its IUPAC name is 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide.

Molecular Properties

Compound Name2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
PubChem CID112729642
Molecular FormulaC13H21NO3
Molecular Weight239.31 g/mol
Exact Mass239.15
IUPAC Name2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
SMILESO=C(CC1CC1)NC1CCC2(CC1)OCCO2
InChIInChI=1S/C13H21NO3/c15-12(9-10-1-2-10)14-11-3-5-13(6-4-11)16-7-8-17-13/h10-11H,1-9H2,(H,14,15)
InChIKeyWLGHAMIQZOKFMT-UHFFFAOYSA-N
XLogP1.59
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.31
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopentyl-2-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
CID 102852259
N-(1,4-dioxaspiro[4.5]decan-8-yl)-3,3-dimethylbutanamide
CID 112729599
2-(1,4-dioxaspiro[4.5]decan-8-yl)-N-propan-2-ylacetamide
CID 102852256
N-cyclopentyl-2-cyclopropylacetamide
CID 60753480
2-(1,4-dioxaspiro[4.5]decan-8-yl)-N-prop-2-enylacetamide
CID 102852267
N-cyclopropyl-2-[1,4-dioxaspiro[4.5]decan-8-yl(methyl)amino]acetamide
CID 79120233
2-[cyclopentyl(ethyl)amino]-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
CID 87017401
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2,2-dimethylbutanamide
CID 78918296
N-(1,4-dioxaspiro[4.4]nonan-8-yl)-2-(methylamino)acetamide
CID 130905377
N-(1,4-dioxaspiro[4.5]decan-8-yl)-2,2-difluorobutanamide
CID 164651542
1-(1,4-dioxaspiro[4.5]decan-8-yl)-3-prop-2-enylurea
CID 130752274
2-[(4aS,8aS)-3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl]-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide
CID 95157303

Frequently Asked Questions

What is the IUPAC name of 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide?
The IUPAC name of 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide (CID 112729642) is 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide.
What is the SMILES notation for 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide?
The canonical SMILES for 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide is O=C(CC1CC1)NC1CCC2(CC1)OCCO2.
What is the InChIKey of 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide?
The InChIKey is WLGHAMIQZOKFMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO3/c15-12(9-10-1-2-10)14-11-3-5-13(6-4-11)16-7-8-17-13/h10-11H,1-9H2,(H,14,15).
What are the key properties of 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide?
2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide has a molecular weight of 239.31 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-N-(1,4-dioxaspiro[4.5]decan-8-yl)acetamide is sourced from PubChem (CID 112729642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).