2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine

C14H27NO — CID 103169739

IUPAC2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
SMILESCC1(C)CC(C(N)CC2CCC2)C(C)(C)O1
InChIInChI=1S/C14H27NO/c1-13(2)9-11(14(3,4)16-13)12(15)8-10-6-5-7-10/h10-12H,5-9,15H2,1-4H3
InChIKeyXMDFPZPHNVJCOZ-UHFFFAOYSA-N
MW225.38 g/mol
LogP3.10
Rot. Bonds3

About 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine

2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine (PubChem CID 103169739) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine.

Molecular Properties

Compound Name2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
PubChem CID103169739
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine
SMILESCC1(C)CC(C(N)CC2CCC2)C(C)(C)O1
InChIInChI=1S/C14H27NO/c1-13(2)9-11(14(3,4)16-13)12(15)8-10-6-5-7-10/h10-12H,5-9,15H2,1-4H3
InChIKeyXMDFPZPHNVJCOZ-UHFFFAOYSA-N
XLogP3.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Cyclobutyl(oxolan-3-yl)methanamine
CID 64986324
(4,4-Difluorocyclohexyl)-(2,2,5,5-tetramethyloxolan-3-yl)methanamine
CID 105189260
4,4,4-Trifluoro-1-(2,2,5,5-tetramethyloxolan-3-yl)butan-1-amine
CID 114623314
3-Fluoro-3-(2,2,5,5-tetramethyloxolan-3-yl)cyclobutan-1-amine
CID 114624510
1-(3,4,5-Trimethyloxolan-2-yl)propan-2-amine
CID 163557055
2-(5,5-Dimethyloxolan-2-yl)-4-ethyl-5-methylhexan-1-amine
CID 166992026
4-Ethyl-1-(oxolan-2-yl)octan-2-amine
CID 61672541
4-Methyl-1-(oxolan-2-yl)heptan-2-amine
CID 62601065
4-Methyl-1-(oxolan-2-yl)hexan-2-amine
CID 62601236
4-Methyl-3-(oxolan-2-ylmethyl)pentan-2-amine
CID 62913992
4-Methyl-1-(oxolan-3-yl)pentan-1-amine
CID 63563617
1-Cyclobutyl-2-(oxolan-2-yl)ethanamine
CID 64986731

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The IUPAC name of 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine (CID 103169739) is 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine.
What is the SMILES notation for 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The canonical SMILES for 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine is CC1(C)CC(C(N)CC2CCC2)C(C)(C)O1.
What is the InChIKey of 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
The InChIKey is XMDFPZPHNVJCOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-13(2)9-11(14(3,4)16-13)12(15)8-10-6-5-7-10/h10-12H,5-9,15H2,1-4H3.
What are the key properties of 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine?
2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine has a molecular weight of 225.38 g/mol, XLogP of 3.10, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-1-(2,2,5,5-tetramethyloxolan-3-yl)ethanamine is sourced from PubChem (CID 103169739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).