(2S)-2H-pyran-2-amine

C5H7NO — CID 141254793

IUPAC(2S)-2H-pyran-2-amine
SMILESN[C@@H]1C=CC=CO1
InChIInChI=1S/C5H7NO/c6-5-3-1-2-4-7-5/h1-5H,6H2/t5-/m0/s1
InChIKeyFUHVVLMYNYHJPB-YFKPBYRVSA-N
MW97.12 g/mol
LogP0.37
Rot. Bonds

About (2S)-2H-pyran-2-amine

(2S)-2H-pyran-2-amine (PubChem CID 141254793) has the molecular formula C5H7NO and a molecular weight of 97.12 g/mol. Its IUPAC name is (2S)-2H-pyran-2-amine.

Molecular Properties

Compound Name(2S)-2H-pyran-2-amine
PubChem CID141254793
Molecular FormulaC5H7NO
Molecular Weight97.12 g/mol
Exact Mass97.05
IUPAC Name(2S)-2H-pyran-2-amine
SMILESN[C@@H]1C=CC=CO1
InChIInChI=1S/C5H7NO/c6-5-3-1-2-4-7-5/h1-5H,6H2/t5-/m0/s1
InChIKeyFUHVVLMYNYHJPB-YFKPBYRVSA-N
XLogP0.37
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2H-pyran-2-amine?
The IUPAC name of (2S)-2H-pyran-2-amine (CID 141254793) is (2S)-2H-pyran-2-amine.
What is the SMILES notation for (2S)-2H-pyran-2-amine?
The canonical SMILES for (2S)-2H-pyran-2-amine is N[C@@H]1C=CC=CO1.
What is the InChIKey of (2S)-2H-pyran-2-amine?
The InChIKey is FUHVVLMYNYHJPB-YFKPBYRVSA-N. The full InChI is InChI=1S/C5H7NO/c6-5-3-1-2-4-7-5/h1-5H,6H2/t5-/m0/s1.
What are the key properties of (2S)-2H-pyran-2-amine?
(2S)-2H-pyran-2-amine has a molecular weight of 97.12 g/mol, XLogP of 0.37, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2H-pyran-2-amine is sourced from PubChem (CID 141254793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).