formaldehyde;3-methyl-2H-pyran-2-amine

C7H11NO2 — CID 174376714

IUPACformaldehyde;3-methyl-2H-pyran-2-amine
SMILESC=O.CC1=CC=COC1N
InChIInChI=1S/C6H9NO.CH2O/c1-5-3-2-4-8-6(5)7;1-2/h2-4,6H,7H2,1H3;1H2
InChIKeyZPOANXZRVSVHEG-UHFFFAOYSA-N
MW141.17 g/mol
LogP0.58
Rot. Bonds

About formaldehyde;3-methyl-2H-pyran-2-amine

formaldehyde;3-methyl-2H-pyran-2-amine (PubChem CID 174376714) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is formaldehyde;3-methyl-2H-pyran-2-amine.

Molecular Properties

Compound Nameformaldehyde;3-methyl-2H-pyran-2-amine
PubChem CID174376714
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Nameformaldehyde;3-methyl-2H-pyran-2-amine
SMILESC=O.CC1=CC=COC1N
InChIInChI=1S/C6H9NO.CH2O/c1-5-3-2-4-8-6(5)7;1-2/h2-4,6H,7H2,1H3;1H2
InChIKeyZPOANXZRVSVHEG-UHFFFAOYSA-N
XLogP0.58
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of formaldehyde;3-methyl-2H-pyran-2-amine?
The IUPAC name of formaldehyde;3-methyl-2H-pyran-2-amine (CID 174376714) is formaldehyde;3-methyl-2H-pyran-2-amine.
What is the SMILES notation for formaldehyde;3-methyl-2H-pyran-2-amine?
The canonical SMILES for formaldehyde;3-methyl-2H-pyran-2-amine is C=O.CC1=CC=COC1N.
What is the InChIKey of formaldehyde;3-methyl-2H-pyran-2-amine?
The InChIKey is ZPOANXZRVSVHEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO.CH2O/c1-5-3-2-4-8-6(5)7;1-2/h2-4,6H,7H2,1H3;1H2.
What are the key properties of formaldehyde;3-methyl-2H-pyran-2-amine?
formaldehyde;3-methyl-2H-pyran-2-amine has a molecular weight of 141.17 g/mol, XLogP of 0.58, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for formaldehyde;3-methyl-2H-pyran-2-amine is sourced from PubChem (CID 174376714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).