3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide

C16H30N2O2 — CID 65167588

IUPAC3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide
SMILESCCOC1CC(NCCC(=O)N(C)C)C12CCCCC2
InChIInChI=1S/C16H30N2O2/c1-4-20-14-12-13(16(14)9-6-5-7-10-16)17-11-8-15(19)18(2)3/h13-14,17H,4-12H2,1-3H3
InChIKeyIQSJAEJJDXIIPO-UHFFFAOYSA-N
MW282.43 g/mol
LogP2.18
Rot. Bonds6

About 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide

3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide (PubChem CID 65167588) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide
PubChem CID65167588
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide
SMILESCCOC1CC(NCCC(=O)N(C)C)C12CCCCC2
InChIInChI=1S/C16H30N2O2/c1-4-20-14-12-13(16(14)9-6-5-7-10-16)17-11-8-15(19)18(2)3/h13-14,17H,4-12H2,1-3H3
InChIKeyIQSJAEJJDXIIPO-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[2-[(3-ethoxyspiro[3.4]octan-1-yl)amino]ethyl]-1,1-dimethylurea
CID 83117181
2-[(3-ethoxyspiro[3.3]heptan-1-yl)amino]-N,N-dimethylacetamide
CID 65295630
N-(3-ethoxyspiro[3.4]octan-1-yl)-N',N'-diethylethane-1,2-diamine
CID 64862891
N-(3-ethoxyspiro[3.5]nonan-1-yl)acetamide
CID 86769478
3-ethoxy-N-(4-methylpentyl)spiro[3.5]nonan-1-amine
CID 65167976
3-ethoxy-N-[(E)-pent-3-enyl]spiro[3.4]octan-1-amine
CID 115906306
5-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]pentan-2-ol
CID 107270264
3-ethoxy-N-octylspiro[3.4]octan-1-amine
CID 115567181
2-[(3-ethoxyspiro[3.4]octan-1-yl)amino]-N-ethylacetamide
CID 64864422
2-[2-[(3-ethoxyspiro[3.4]octan-1-yl)amino]ethoxy]ethanol
CID 64862901
2-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N-(2-methoxyethyl)acetamide
CID 115905391
1-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]propan-2-ol
CID 65168000

Frequently Asked Questions

What is the IUPAC name of 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide?
The IUPAC name of 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide (CID 65167588) is 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide is CCOC1CC(NCCC(=O)N(C)C)C12CCCCC2.
What is the InChIKey of 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide?
The InChIKey is IQSJAEJJDXIIPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-4-20-14-12-13(16(14)9-6-5-7-10-16)17-11-8-15(19)18(2)3/h13-14,17H,4-12H2,1-3H3.
What are the key properties of 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide?
3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide has a molecular weight of 282.43 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-ethoxyspiro[3.5]nonan-1-yl)amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 65167588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).