N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide

C21H26N2O2 — CID 2166461

IUPACN-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide
SMILESO=C(NCCCN1CCOCC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26N2O2/c24-21(22-12-7-13-23-14-16-25-17-15-23)20(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,22,24)
InChIKeyZUTYZCNYTDXKPB-UHFFFAOYSA-N
MW338.45 g/mol
LogP2.66
Rot. Bonds7

About N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide

N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide (PubChem CID 2166461) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide
PubChem CID2166461
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide
SMILESO=C(NCCCN1CCOCC1)C(c1ccccc1)c1ccccc1
InChIInChI=1S/C21H26N2O2/c24-21(22-12-7-13-23-14-16-25-17-15-23)20(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,22,24)
InChIKeyZUTYZCNYTDXKPB-UHFFFAOYSA-N
XLogP2.66
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide (CID 2166461) is N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide is O=C(NCCCN1CCOCC1)C(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide?
The InChIKey is ZUTYZCNYTDXKPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c24-21(22-12-7-13-23-14-16-25-17-15-23)20(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-6,8-11,20H,7,12-17H2,(H,22,24).
What are the key properties of N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide?
N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide has a molecular weight of 338.45 g/mol, XLogP of 2.66, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-2,2-diphenylacetamide is sourced from PubChem (CID 2166461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).