5-ethyloxolan-3-amine

C6H13NO — CID 89032290

IUPAC5-ethyloxolan-3-amine
SMILESCCC1CC(N)CO1
InChIInChI=1S/C6H13NO/c1-2-6-3-5(7)4-8-6/h5-6H,2-4,7H2,1H3
InChIKeyKJUVIKMUFILTGL-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.51
Rot. Bonds1

About 5-ethyloxolan-3-amine

5-ethyloxolan-3-amine (PubChem CID 89032290) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 5-ethyloxolan-3-amine.

Molecular Properties

Compound Name5-ethyloxolan-3-amine
PubChem CID89032290
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name5-ethyloxolan-3-amine
SMILESCCC1CC(N)CO1
InChIInChI=1S/C6H13NO/c1-2-6-3-5(7)4-8-6/h5-6H,2-4,7H2,1H3
InChIKeyKJUVIKMUFILTGL-UHFFFAOYSA-N
XLogP0.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,4R)-2-ethyloxan-4-amine
CID 82651052
(3S,5S)-5-(methoxymethyl)oxolan-3-amine
CID 131220331
(4R)-6-ethyloxane-3,4-diol
CID 90277867
tetrakis(2-ethyloxirane);methane
CID 162010408
[(2S,4S)-4-ethyloxolan-2-yl]methanol
CID 124585151
dimethylsilane;2-ethyloxirane
CID 175208147
2-ethyl-5-iodo-1,4-dioxane
CID 89143595
5-ethyl-2-methyloxolan-3-amine
CID 59712801
(3S)-6-(aminomethyl)oxan-3-amine
CID 89349437
(2R)-2-ethyl-5-methyloxane
CID 146845250
ethane-1,2-diol;2-ethyloxirane
CID 23290341
5-ethyl-2-methyl-1,4-dioxocane
CID 161066781

Frequently Asked Questions

What is the IUPAC name of 5-ethyloxolan-3-amine?
The IUPAC name of 5-ethyloxolan-3-amine (CID 89032290) is 5-ethyloxolan-3-amine.
What is the SMILES notation for 5-ethyloxolan-3-amine?
The canonical SMILES for 5-ethyloxolan-3-amine is CCC1CC(N)CO1.
What is the InChIKey of 5-ethyloxolan-3-amine?
The InChIKey is KJUVIKMUFILTGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c1-2-6-3-5(7)4-8-6/h5-6H,2-4,7H2,1H3.
What are the key properties of 5-ethyloxolan-3-amine?
5-ethyloxolan-3-amine has a molecular weight of 115.18 g/mol, XLogP of 0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyloxolan-3-amine is sourced from PubChem (CID 89032290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).