(4-phenylphenyl) morpholine-4-carboxylate

C17H17NO3 — CID 1378785

IUPAC(4-phenylphenyl) morpholine-4-carboxylate
SMILESO=C(Oc1ccc(-c2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)21-16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9H,10-13H2
InChIKeyWQDLUJWWLAQRFC-UHFFFAOYSA-N
MW283.33 g/mol
LogP3.18
Rot. Bonds2

About (4-phenylphenyl) morpholine-4-carboxylate

(4-phenylphenyl) morpholine-4-carboxylate (PubChem CID 1378785) has the molecular formula C17H17NO3 and a molecular weight of 283.33 g/mol. Its IUPAC name is (4-phenylphenyl) morpholine-4-carboxylate.

Molecular Properties

Compound Name(4-phenylphenyl) morpholine-4-carboxylate
PubChem CID1378785
Molecular FormulaC17H17NO3
Molecular Weight283.33 g/mol
Exact Mass283.12
IUPAC Name(4-phenylphenyl) morpholine-4-carboxylate
SMILESO=C(Oc1ccc(-c2ccccc2)cc1)N1CCOCC1
InChIInChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)21-16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9H,10-13H2
InChIKeyWQDLUJWWLAQRFC-UHFFFAOYSA-N
XLogP3.18
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-phenylphenyl) morpholine-4-carboxylate?
The IUPAC name of (4-phenylphenyl) morpholine-4-carboxylate (CID 1378785) is (4-phenylphenyl) morpholine-4-carboxylate.
What is the SMILES notation for (4-phenylphenyl) morpholine-4-carboxylate?
The canonical SMILES for (4-phenylphenyl) morpholine-4-carboxylate is O=C(Oc1ccc(-c2ccccc2)cc1)N1CCOCC1.
What is the InChIKey of (4-phenylphenyl) morpholine-4-carboxylate?
The InChIKey is WQDLUJWWLAQRFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO3/c19-17(18-10-12-20-13-11-18)21-16-8-6-15(7-9-16)14-4-2-1-3-5-14/h1-9H,10-13H2.
What are the key properties of (4-phenylphenyl) morpholine-4-carboxylate?
(4-phenylphenyl) morpholine-4-carboxylate has a molecular weight of 283.33 g/mol, XLogP of 3.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylphenyl) morpholine-4-carboxylate is sourced from PubChem (CID 1378785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).