4-(3,6-dihydro-2H-pyran-3-yl)morpholine

C9H15NO2 — CID 22727636

IUPAC4-(3,6-dihydro-2H-pyran-3-yl)morpholine
SMILESC1=CC(N2CCOCC2)COC1
InChIInChI=1S/C9H15NO2/c1-2-9(8-12-5-1)10-3-6-11-7-4-10/h1-2,9H,3-8H2
InChIKeyTYLHFKPPFSOXGG-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.27
Rot. Bonds1

About 4-(3,6-dihydro-2H-pyran-3-yl)morpholine

4-(3,6-dihydro-2H-pyran-3-yl)morpholine (PubChem CID 22727636) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 4-(3,6-dihydro-2H-pyran-3-yl)morpholine.

Molecular Properties

Compound Name4-(3,6-dihydro-2H-pyran-3-yl)morpholine
PubChem CID22727636
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name4-(3,6-dihydro-2H-pyran-3-yl)morpholine
SMILESC1=CC(N2CCOCC2)COC1
InChIInChI=1S/C9H15NO2/c1-2-9(8-12-5-1)10-3-6-11-7-4-10/h1-2,9H,3-8H2
InChIKeyTYLHFKPPFSOXGG-UHFFFAOYSA-N
XLogP0.27
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(3,6-dihydro-2H-pyran-3-yl)morpholine?
The IUPAC name of 4-(3,6-dihydro-2H-pyran-3-yl)morpholine (CID 22727636) is 4-(3,6-dihydro-2H-pyran-3-yl)morpholine.
What is the SMILES notation for 4-(3,6-dihydro-2H-pyran-3-yl)morpholine?
The canonical SMILES for 4-(3,6-dihydro-2H-pyran-3-yl)morpholine is C1=CC(N2CCOCC2)COC1.
What is the InChIKey of 4-(3,6-dihydro-2H-pyran-3-yl)morpholine?
The InChIKey is TYLHFKPPFSOXGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-2-9(8-12-5-1)10-3-6-11-7-4-10/h1-2,9H,3-8H2.
What are the key properties of 4-(3,6-dihydro-2H-pyran-3-yl)morpholine?
4-(3,6-dihydro-2H-pyran-3-yl)morpholine has a molecular weight of 169.22 g/mol, XLogP of 0.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,6-dihydro-2H-pyran-3-yl)morpholine is sourced from PubChem (CID 22727636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).