pyran-2-ylidenemethanamine

C6H7NO — CID 70262351

IUPACpyran-2-ylidenemethanamine
SMILESNC=C1C=CC=CO1
InChIInChI=1S/C6H7NO/c7-5-6-3-1-2-4-8-6/h1-5H,7H2
InChIKeyQKUUPFSOCNASFU-UHFFFAOYSA-N
MW109.13 g/mol
LogP0.89
Rot. Bonds

About pyran-2-ylidenemethanamine

pyran-2-ylidenemethanamine (PubChem CID 70262351) has the molecular formula C6H7NO and a molecular weight of 109.13 g/mol. Its IUPAC name is pyran-2-ylidenemethanamine.

Molecular Properties

Compound Namepyran-2-ylidenemethanamine
PubChem CID70262351
Molecular FormulaC6H7NO
Molecular Weight109.13 g/mol
Exact Mass109.05
IUPAC Namepyran-2-ylidenemethanamine
SMILESNC=C1C=CC=CO1
InChIInChI=1S/C6H7NO/c7-5-6-3-1-2-4-8-6/h1-5H,7H2
InChIKeyQKUUPFSOCNASFU-UHFFFAOYSA-N
XLogP0.89
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.13
LogP ≤ 50.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of pyran-2-ylidenemethanamine?
The IUPAC name of pyran-2-ylidenemethanamine (CID 70262351) is pyran-2-ylidenemethanamine.
What is the SMILES notation for pyran-2-ylidenemethanamine?
The canonical SMILES for pyran-2-ylidenemethanamine is NC=C1C=CC=CO1.
What is the InChIKey of pyran-2-ylidenemethanamine?
The InChIKey is QKUUPFSOCNASFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO/c7-5-6-3-1-2-4-8-6/h1-5H,7H2.
What are the key properties of pyran-2-ylidenemethanamine?
pyran-2-ylidenemethanamine has a molecular weight of 109.13 g/mol, XLogP of 0.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyran-2-ylidenemethanamine is sourced from PubChem (CID 70262351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).