N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide

C13H23NO2 — CID 86769478

IUPACN-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
SMILESCCOC1CC(NC(C)=O)C12CCCCC2
InChIInChI=1S/C13H23NO2/c1-3-16-12-9-11(14-10(2)15)13(12)7-5-4-6-8-13/h11-12H,3-9H2,1-2H3,(H,14,15)
InChIKeyCXLNJOZSTFFEFK-UHFFFAOYSA-N
MW225.33 g/mol
LogP2.25
Rot. Bonds3

About N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide

N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide (PubChem CID 86769478) has the molecular formula C13H23NO2 and a molecular weight of 225.33 g/mol. Its IUPAC name is N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
PubChem CID86769478
Molecular FormulaC13H23NO2
Molecular Weight225.33 g/mol
Exact Mass225.17
IUPAC NameN-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
SMILESCCOC1CC(NC(C)=O)C12CCCCC2
InChIInChI=1S/C13H23NO2/c1-3-16-12-9-11(14-10(2)15)13(12)7-5-4-6-8-13/h11-12H,3-9H2,1-2H3,(H,14,15)
InChIKeyCXLNJOZSTFFEFK-UHFFFAOYSA-N
XLogP2.25
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.33
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-amino-N-(3-ethoxyspiro[3.5]nonan-1-yl)propanamide
CID 119335880
N-(3-ethoxyspiro[3.4]octan-1-yl)-2-(methylamino)acetamide
CID 119794737
1-(carbamoylamino)-N-[(1R,3R)-3-ethoxyspiro[3.5]nonan-1-yl]cyclopropane-1-carboxamide
CID 124590561
N-(3-ethoxyspiro[3.3]heptan-1-yl)-2-(1-hydroxycyclopentyl)acetamide
CID 111540303
3-amino-N-(3-ethoxyspiro[3.4]octan-1-yl)propanamide;hydrochloride
CID 119329855
(2S)-N-[(1S,3R)-3-ethoxyspiro[3.5]nonan-1-yl]-2-propan-2-ylsulfonylpropanamide
CID 100577324
3-[(3-ethoxyspiro[3.5]nonan-1-yl)carbamoylamino]propanoic acid
CID 122005372
N-(3-ethoxyspiro[3.4]octan-1-yl)-2-methyl-3-(methylamino)propanamide
CID 119794749
N-(3-ethoxyspiro[3.5]nonan-1-yl)pyrrolidine-2-carboxamide
CID 119335892
7-amino-N-(3-ethoxyspiro[3.5]nonan-1-yl)heptanamide
CID 119805159
3-amino-N-(3-ethoxyspiro[3.3]heptan-1-yl)propanamide
CID 119334931
(1S,3R)-3-ethoxy-N-methylspiro[3.4]octan-1-amine
CID 95241163

Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide?
The IUPAC name of N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide (CID 86769478) is N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide.
What is the SMILES notation for N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide?
The canonical SMILES for N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide is CCOC1CC(NC(C)=O)C12CCCCC2.
What is the InChIKey of N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide?
The InChIKey is CXLNJOZSTFFEFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23NO2/c1-3-16-12-9-11(14-10(2)15)13(12)7-5-4-6-8-13/h11-12H,3-9H2,1-2H3,(H,14,15).
What are the key properties of N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide?
N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide has a molecular weight of 225.33 g/mol, XLogP of 2.25, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide is sourced from PubChem (CID 86769478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).