2-(oxolan-2-yl)ethanamine

C6H13NO — CID 4854736

IUPAC2-(oxolan-2-yl)ethanamine
SMILESNCCC1CCCO1
InChIInChI=1S/C6H13NO/c7-4-3-6-2-1-5-8-6/h6H,1-5,7H2
InChIKeyZCOIVJPCZLPQPT-UHFFFAOYSA-N
MW115.18 g/mol
LogP0.51
Rot. Bonds2

About 2-(oxolan-2-yl)ethanamine

2-(oxolan-2-yl)ethanamine (PubChem CID 4854736) has the molecular formula C6H13NO and a molecular weight of 115.18 g/mol. Its IUPAC name is 2-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound Name2-(oxolan-2-yl)ethanamine
PubChem CID4854736
Molecular FormulaC6H13NO
Molecular Weight115.18 g/mol
Exact Mass115.10
IUPAC Name2-(oxolan-2-yl)ethanamine
SMILESNCCC1CCCO1
InChIInChI=1S/C6H13NO/c7-4-3-6-2-1-5-8-6/h6H,1-5,7H2
InChIKeyZCOIVJPCZLPQPT-UHFFFAOYSA-N
XLogP0.51
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-2-yl)ethanamine?
The IUPAC name of 2-(oxolan-2-yl)ethanamine (CID 4854736) is 2-(oxolan-2-yl)ethanamine.
What is the SMILES notation for 2-(oxolan-2-yl)ethanamine?
The canonical SMILES for 2-(oxolan-2-yl)ethanamine is NCCC1CCCO1.
What is the InChIKey of 2-(oxolan-2-yl)ethanamine?
The InChIKey is ZCOIVJPCZLPQPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13NO/c7-4-3-6-2-1-5-8-6/h6H,1-5,7H2.
What are the key properties of 2-(oxolan-2-yl)ethanamine?
2-(oxolan-2-yl)ethanamine has a molecular weight of 115.18 g/mol, XLogP of 0.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 4854736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).