[(2S)-oxolan-2-yl]methanamine

C5H11NO — CID 641530

IUPAC[(2S)-oxolan-2-yl]methanamine
SMILESNC[C@@H]1CCCO1
InChIInChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m0/s1
InChIKeyYNOGYQAEJGADFJ-YFKPBYRVSA-N
MW101.15 g/mol
LogP0.12
Rot. Bonds1

About [(2S)-oxolan-2-yl]methanamine

[(2S)-oxolan-2-yl]methanamine (PubChem CID 641530) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is [(2S)-oxolan-2-yl]methanamine.

Molecular Properties

Compound Name[(2S)-oxolan-2-yl]methanamine
PubChem CID641530
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name[(2S)-oxolan-2-yl]methanamine
SMILESNC[C@@H]1CCCO1
InChIInChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m0/s1
InChIKeyYNOGYQAEJGADFJ-YFKPBYRVSA-N
XLogP0.12
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 ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(2S)-oxolan-2-yl]methanamine?
The IUPAC name of [(2S)-oxolan-2-yl]methanamine (CID 641530) is [(2S)-oxolan-2-yl]methanamine.
What is the SMILES notation for [(2S)-oxolan-2-yl]methanamine?
The canonical SMILES for [(2S)-oxolan-2-yl]methanamine is NC[C@@H]1CCCO1.
What is the InChIKey of [(2S)-oxolan-2-yl]methanamine?
The InChIKey is YNOGYQAEJGADFJ-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H11NO/c6-4-5-2-1-3-7-5/h5H,1-4,6H2/t5-/m0/s1.
What are the key properties of [(2S)-oxolan-2-yl]methanamine?
[(2S)-oxolan-2-yl]methanamine has a molecular weight of 101.15 g/mol, XLogP of 0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S)-oxolan-2-yl]methanamine is sourced from PubChem (CID 641530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).