oxolan-3-ylmethanamine

C5H11NO — CID 10898660

IUPACoxolan-3-ylmethanamine
SMILESNCC1CCOC1
InChIInChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2
InChIKeyCINJIXGRSTYIHP-UHFFFAOYSA-N
MW101.15 g/mol
LogP-0.02
Rot. Bonds1

About oxolan-3-ylmethanamine

oxolan-3-ylmethanamine (PubChem CID 10898660) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is oxolan-3-ylmethanamine.

Molecular Properties

Compound Nameoxolan-3-ylmethanamine
PubChem CID10898660
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Nameoxolan-3-ylmethanamine
SMILESNCC1CCOC1
InChIInChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2
InChIKeyCINJIXGRSTYIHP-UHFFFAOYSA-N
XLogP-0.02
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 5-0.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of oxolan-3-ylmethanamine?
The IUPAC name of oxolan-3-ylmethanamine (CID 10898660) is oxolan-3-ylmethanamine.
What is the SMILES notation for oxolan-3-ylmethanamine?
The canonical SMILES for oxolan-3-ylmethanamine is NCC1CCOC1.
What is the InChIKey of oxolan-3-ylmethanamine?
The InChIKey is CINJIXGRSTYIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c6-3-5-1-2-7-4-5/h5H,1-4,6H2.
What are the key properties of oxolan-3-ylmethanamine?
oxolan-3-ylmethanamine has a molecular weight of 101.15 g/mol, XLogP of -0.02, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for oxolan-3-ylmethanamine is sourced from PubChem (CID 10898660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).