5-benzyl-3-ethyl-2-phenylmorpholine

C19H23NO — CID 63261636

IUPAC5-benzyl-3-ethyl-2-phenylmorpholine
SMILESCCC1NC(Cc2ccccc2)COC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-2-18-19(16-11-7-4-8-12-16)21-14-17(20-18)13-15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3
InChIKeyCJSQTCUVUDWCHH-UHFFFAOYSA-N
MW281.40 g/mol
LogP3.74
Rot. Bonds4

About 5-benzyl-3-ethyl-2-phenylmorpholine

5-benzyl-3-ethyl-2-phenylmorpholine (PubChem CID 63261636) has the molecular formula C19H23NO and a molecular weight of 281.40 g/mol. Its IUPAC name is 5-benzyl-3-ethyl-2-phenylmorpholine.

Molecular Properties

Compound Name5-benzyl-3-ethyl-2-phenylmorpholine
PubChem CID63261636
Molecular FormulaC19H23NO
Molecular Weight281.40 g/mol
Exact Mass281.18
IUPAC Name5-benzyl-3-ethyl-2-phenylmorpholine
SMILESCCC1NC(Cc2ccccc2)COC1c1ccccc1
InChIInChI=1S/C19H23NO/c1-2-18-19(16-11-7-4-8-12-16)21-14-17(20-18)13-15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3
InChIKeyCJSQTCUVUDWCHH-UHFFFAOYSA-N
XLogP3.74
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.40
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-benzyl-3-ethyl-2-phenylmorpholine?
The IUPAC name of 5-benzyl-3-ethyl-2-phenylmorpholine (CID 63261636) is 5-benzyl-3-ethyl-2-phenylmorpholine.
What is the SMILES notation for 5-benzyl-3-ethyl-2-phenylmorpholine?
The canonical SMILES for 5-benzyl-3-ethyl-2-phenylmorpholine is CCC1NC(Cc2ccccc2)COC1c1ccccc1.
What is the InChIKey of 5-benzyl-3-ethyl-2-phenylmorpholine?
The InChIKey is CJSQTCUVUDWCHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO/c1-2-18-19(16-11-7-4-8-12-16)21-14-17(20-18)13-15-9-5-3-6-10-15/h3-12,17-20H,2,13-14H2,1H3.
What are the key properties of 5-benzyl-3-ethyl-2-phenylmorpholine?
5-benzyl-3-ethyl-2-phenylmorpholine has a molecular weight of 281.40 g/mol, XLogP of 3.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-3-ethyl-2-phenylmorpholine is sourced from PubChem (CID 63261636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).