2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine

C15H29NO2 — CID 102896081

IUPAC2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine
SMILESCCC(CC)(CN)OCC1CCC2(CCCC2)O1
InChIInChI=1S/C15H29NO2/c1-3-14(4-2,12-16)17-11-13-7-10-15(18-13)8-5-6-9-15/h13H,3-12,16H2,1-2H3
InChIKeyFNXBVINWINYTCN-UHFFFAOYSA-N
MW255.40 g/mol
LogP3.01
Rot. Bonds6

About 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine

2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine (PubChem CID 102896081) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine.

Molecular Properties

Compound Name2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine
PubChem CID102896081
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine
SMILESCCC(CC)(CN)OCC1CCC2(CCCC2)O1
InChIInChI=1S/C15H29NO2/c1-3-14(4-2,12-16)17-11-13-7-10-15(18-13)8-5-6-9-15/h13H,3-12,16H2,1-2H3
InChIKeyFNXBVINWINYTCN-UHFFFAOYSA-N
XLogP3.01
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine with MolForge

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Related Compounds

1-oxaspiro[4.7]dodecan-2-ylmethanamine
CID 130583709
3-(1-oxaspiro[4.5]decan-2-ylmethoxy)propan-1-amine
CID 102898863
ethyl 2-(aminomethyl)-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butanoate
CID 106487561
2-(aminomethyl)-2-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propanoic acid
CID 106489673
[2-(1-oxaspiro[4.4]nonan-2-ylmethoxymethyl)cyclopentyl]methanamine
CID 102898886
2-[(3,3-difluorocyclohexyl)methoxy]-2-ethylbutan-1-amine
CID 114223589
methyl 2-(aminomethyl)-2-cyclopropyl-3-(1-oxaspiro[4.5]decan-2-yl)propanoate
CID 106489501
2-ethyl-2-(1-oxaspiro[4.5]decan-2-ylmethyl)butan-1-ol
CID 102902006
2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)cyclopentan-1-amine
CID 102898902
2-[(4-ethylphenoxy)methyl]-1-oxaspiro[4.4]nonane
CID 102901507
2-ethyl-2-(1-oxaspiro[5.5]undecan-4-yloxy)butan-1-amine
CID 79905252
[1-(1-oxaspiro[4.4]nonan-2-ylmethyl)cyclooctyl]methanamine
CID 102901881

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine?
The IUPAC name of 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine (CID 102896081) is 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine.
What is the SMILES notation for 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine?
The canonical SMILES for 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine is CCC(CC)(CN)OCC1CCC2(CCCC2)O1.
What is the InChIKey of 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine?
The InChIKey is FNXBVINWINYTCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-3-14(4-2,12-16)17-11-13-7-10-15(18-13)8-5-6-9-15/h13H,3-12,16H2,1-2H3.
What are the key properties of 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine?
2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine has a molecular weight of 255.40 g/mol, XLogP of 3.01, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-(1-oxaspiro[4.4]nonan-2-ylmethoxy)butan-1-amine is sourced from PubChem (CID 102896081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).