bis(N-(4-hydroxyphenyl)acetamide);morpholine

C20H27N3O5 — CID 86210685

IUPACbis(N-(4-hydroxyphenyl)acetamide);morpholine
SMILESC1COCCN1.CC(=O)Nc1ccc(O)cc1.CC(=O)Nc1ccc(O)cc1
InChIInChI=1S/2C8H9NO2.C4H9NO/c2*1-6(10)9-7-2-4-8(11)5-3-7;1-3-6-4-2-5-1/h2*2-5,11H,1H3,(H,9,10);5H,1-4H2
InChIKeyCRQSMEVWLYRFIF-UHFFFAOYSA-N
MW389.45 g/mol
LogP2.31
Rot. Bonds2

About bis(N-(4-hydroxyphenyl)acetamide);morpholine

bis(N-(4-hydroxyphenyl)acetamide);morpholine (PubChem CID 86210685) has the molecular formula C20H27N3O5 and a molecular weight of 389.45 g/mol. Its IUPAC name is bis(N-(4-hydroxyphenyl)acetamide);morpholine.

Molecular Properties

Compound Namebis(N-(4-hydroxyphenyl)acetamide);morpholine
PubChem CID86210685
Molecular FormulaC20H27N3O5
Molecular Weight389.45 g/mol
Exact Mass389.20
IUPAC Namebis(N-(4-hydroxyphenyl)acetamide);morpholine
SMILESC1COCCN1.CC(=O)Nc1ccc(O)cc1.CC(=O)Nc1ccc(O)cc1
InChIInChI=1S/2C8H9NO2.C4H9NO/c2*1-6(10)9-7-2-4-8(11)5-3-7;1-3-6-4-2-5-1/h2*2-5,11H,1H3,(H,9,10);5H,1-4H2
InChIKeyCRQSMEVWLYRFIF-UHFFFAOYSA-N
XLogP2.31
TPSA119.92 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.45
LogP ≤ 52.31
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(N-(4-hydroxyphenyl)acetamide);morpholine?
The IUPAC name of bis(N-(4-hydroxyphenyl)acetamide);morpholine (CID 86210685) is bis(N-(4-hydroxyphenyl)acetamide);morpholine.
What is the SMILES notation for bis(N-(4-hydroxyphenyl)acetamide);morpholine?
The canonical SMILES for bis(N-(4-hydroxyphenyl)acetamide);morpholine is C1COCCN1.CC(=O)Nc1ccc(O)cc1.CC(=O)Nc1ccc(O)cc1.
What is the InChIKey of bis(N-(4-hydroxyphenyl)acetamide);morpholine?
The InChIKey is CRQSMEVWLYRFIF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C8H9NO2.C4H9NO/c2*1-6(10)9-7-2-4-8(11)5-3-7;1-3-6-4-2-5-1/h2*2-5,11H,1H3,(H,9,10);5H,1-4H2.
What are the key properties of bis(N-(4-hydroxyphenyl)acetamide);morpholine?
bis(N-(4-hydroxyphenyl)acetamide);morpholine has a molecular weight of 389.45 g/mol, XLogP of 2.31, 2 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for bis(N-(4-hydroxyphenyl)acetamide);morpholine is sourced from PubChem (CID 86210685), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).