N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide

C19H22N2O2 — CID 730073

IUPACN-(4-morpholin-4-ylphenyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H22N2O2/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)21-12-14-23-15-13-21/h1-5,7-10H,6,11-15H2,(H,20,22)
InChIKeyXTFSERJDNQFZMT-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.09
Rot. Bonds5

About N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide

N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide (PubChem CID 730073) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide.

Molecular Properties

Compound NameN-(4-morpholin-4-ylphenyl)-3-phenylpropanamide
PubChem CID730073
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(4-morpholin-4-ylphenyl)-3-phenylpropanamide
SMILESO=C(CCc1ccccc1)Nc1ccc(N2CCOCC2)cc1
InChIInChI=1S/C19H22N2O2/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)21-12-14-23-15-13-21/h1-5,7-10H,6,11-15H2,(H,20,22)
InChIKeyXTFSERJDNQFZMT-UHFFFAOYSA-N
XLogP3.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide?
The IUPAC name of N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide (CID 730073) is N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide.
What is the SMILES notation for N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide?
The canonical SMILES for N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide is O=C(CCc1ccccc1)Nc1ccc(N2CCOCC2)cc1.
What is the InChIKey of N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide?
The InChIKey is XTFSERJDNQFZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-19(11-6-16-4-2-1-3-5-16)20-17-7-9-18(10-8-17)21-12-14-23-15-13-21/h1-5,7-10H,6,11-15H2,(H,20,22).
What are the key properties of N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide?
N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide has a molecular weight of 310.40 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-morpholin-4-ylphenyl)-3-phenylpropanamide is sourced from PubChem (CID 730073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).