N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide

C21H26N2O3 — CID 25014774

IUPACN-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(OCCCN2CCOCC2)cc1
InChIInChI=1S/C21H26N2O3/c24-21(17-18-5-2-1-3-6-18)22-19-7-9-20(10-8-19)26-14-4-11-23-12-15-25-16-13-23/h1-3,5-10H,4,11-17H2,(H,22,24)
InChIKeyNVGSVTQMCHKNQX-UHFFFAOYSA-N
MW354.45 g/mol
LogP2.97
Rot. Bonds8

About N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide

N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide (PubChem CID 25014774) has the molecular formula C21H26N2O3 and a molecular weight of 354.45 g/mol. Its IUPAC name is N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide
PubChem CID25014774
Molecular FormulaC21H26N2O3
Molecular Weight354.45 g/mol
Exact Mass354.19
IUPAC NameN-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide
SMILESO=C(Cc1ccccc1)Nc1ccc(OCCCN2CCOCC2)cc1
InChIInChI=1S/C21H26N2O3/c24-21(17-18-5-2-1-3-6-18)22-19-7-9-20(10-8-19)26-14-4-11-23-12-15-25-16-13-23/h1-3,5-10H,4,11-17H2,(H,22,24)
InChIKeyNVGSVTQMCHKNQX-UHFFFAOYSA-N
XLogP2.97
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.45
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide?
The IUPAC name of N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide (CID 25014774) is N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide.
What is the SMILES notation for N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide?
The canonical SMILES for N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide is O=C(Cc1ccccc1)Nc1ccc(OCCCN2CCOCC2)cc1.
What is the InChIKey of N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide?
The InChIKey is NVGSVTQMCHKNQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O3/c24-21(17-18-5-2-1-3-6-18)22-19-7-9-20(10-8-19)26-14-4-11-23-12-15-25-16-13-23/h1-3,5-10H,4,11-17H2,(H,22,24).
What are the key properties of N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide?
N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide has a molecular weight of 354.45 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-morpholin-4-ylpropoxy)phenyl]-2-phenylacetamide is sourced from PubChem (CID 25014774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).