4-(1H-inden-2-yl)morpholine

C13H15NO — CID 2817252

IUPAC4-(1H-inden-2-yl)morpholine
SMILESC1=C(N2CCOCC2)Cc2ccccc21
InChIInChI=1S/C13H15NO/c1-2-4-12-10-13(9-11(12)3-1)14-5-7-15-8-6-14/h1-4,9H,5-8,10H2
InChIKeyCUPIANNSPOAEQQ-UHFFFAOYSA-N
MW201.27 g/mol
LogP1.92
Rot. Bonds1

About 4-(1H-inden-2-yl)morpholine

4-(1H-inden-2-yl)morpholine (PubChem CID 2817252) has the molecular formula C13H15NO and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(1H-inden-2-yl)morpholine.

Molecular Properties

Compound Name4-(1H-inden-2-yl)morpholine
PubChem CID2817252
Molecular FormulaC13H15NO
Molecular Weight201.27 g/mol
Exact Mass201.12
IUPAC Name4-(1H-inden-2-yl)morpholine
SMILESC1=C(N2CCOCC2)Cc2ccccc21
InChIInChI=1S/C13H15NO/c1-2-4-12-10-13(9-11(12)3-1)14-5-7-15-8-6-14/h1-4,9H,5-8,10H2
InChIKeyCUPIANNSPOAEQQ-UHFFFAOYSA-N
XLogP1.92
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_ene_B(4)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(1H-inden-2-yl)morpholine?
The IUPAC name of 4-(1H-inden-2-yl)morpholine (CID 2817252) is 4-(1H-inden-2-yl)morpholine.
What is the SMILES notation for 4-(1H-inden-2-yl)morpholine?
The canonical SMILES for 4-(1H-inden-2-yl)morpholine is C1=C(N2CCOCC2)Cc2ccccc21.
What is the InChIKey of 4-(1H-inden-2-yl)morpholine?
The InChIKey is CUPIANNSPOAEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15NO/c1-2-4-12-10-13(9-11(12)3-1)14-5-7-15-8-6-14/h1-4,9H,5-8,10H2.
What are the key properties of 4-(1H-inden-2-yl)morpholine?
4-(1H-inden-2-yl)morpholine has a molecular weight of 201.27 g/mol, XLogP of 1.92, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1H-inden-2-yl)morpholine is sourced from PubChem (CID 2817252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).