2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide

C22H28N2O4 — CID 48664298

IUPAC2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide
SMILESCOc1ccc(OC(C)C(=O)NC(C)c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C22H28N2O4/c1-16(18-4-6-19(7-5-18)24-12-14-27-15-13-24)23-22(25)17(2)28-21-10-8-20(26-3)9-11-21/h4-11,16-17H,12-15H2,1-3H3,(H,23,25)
InChIKeyIWNASIVFVIJILE-UHFFFAOYSA-N
MW384.48 g/mol
LogP3.18
Rot. Bonds7

About 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide

2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide (PubChem CID 48664298) has the molecular formula C22H28N2O4 and a molecular weight of 384.48 g/mol. Its IUPAC name is 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide.

Molecular Properties

Compound Name2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide
PubChem CID48664298
Molecular FormulaC22H28N2O4
Molecular Weight384.48 g/mol
Exact Mass384.20
IUPAC Name2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide
SMILESCOc1ccc(OC(C)C(=O)NC(C)c2ccc(N3CCOCC3)cc2)cc1
InChIInChI=1S/C22H28N2O4/c1-16(18-4-6-19(7-5-18)24-12-14-27-15-13-24)23-22(25)17(2)28-21-10-8-20(26-3)9-11-21/h4-11,16-17H,12-15H2,1-3H3,(H,23,25)
InChIKeyIWNASIVFVIJILE-UHFFFAOYSA-N
XLogP3.18
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

(2R)-N-[(1S)-1-(4-morpholin-4-ylphenyl)ethyl]-2-phenoxypropanamide
CID 95705953
N-[(1S)-1-(4-methoxyphenyl)ethyl]-4-morpholin-4-ylbenzamide
CID 92674988
(2R)-N-[(1R)-1-(4-methoxyphenyl)ethyl]-2-(4-methylphenoxy)propanamide
CID 92680833
4-(4-methoxyphenyl)-N-[1-(4-morpholin-4-ylphenyl)ethyl]oxane-4-carboxamide
CID 46977488
(2R)-2-(4-chlorophenoxy)-N-[(1S)-1-(4-methoxyphenyl)ethyl]propanamide
CID 99130919
(2S)-2-(4-bromophenoxy)-N-[(1S)-1-(4-methoxyphenyl)ethyl]propanamide
CID 94843875
2-(4-chlorophenoxy)-N-[1-(4-methoxyphenyl)ethyl]propanamide
CID 53282264
1-(4-methoxyphenyl)-3-[1-(4-morpholin-4-ylphenyl)ethyl]thiourea
CID 48628219
(2S)-2-(3-methoxyphenoxy)-N-[(1R)-1-(4-methoxyphenyl)ethyl]propanamide
CID 93486457
N-[1-(4-piperidin-1-ylphenyl)ethyl]-2-(5,6,7,8-tetrahydronaphthalen-2-yloxy)propanamide
CID 133210391
(2S)-N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-naphthalen-2-yloxypropanamide
CID 92674006
4-methoxy-N-[1-(4-morpholin-4-ylphenyl)ethyl]pyridine-2-carboxamide
CID 166208501

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide?
The IUPAC name of 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide (CID 48664298) is 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide.
What is the SMILES notation for 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide?
The canonical SMILES for 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide is COc1ccc(OC(C)C(=O)NC(C)c2ccc(N3CCOCC3)cc2)cc1.
What is the InChIKey of 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide?
The InChIKey is IWNASIVFVIJILE-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O4/c1-16(18-4-6-19(7-5-18)24-12-14-27-15-13-24)23-22(25)17(2)28-21-10-8-20(26-3)9-11-21/h4-11,16-17H,12-15H2,1-3H3,(H,23,25).
What are the key properties of 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide?
2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide has a molecular weight of 384.48 g/mol, XLogP of 3.18, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenoxy)-N-[1-(4-morpholin-4-ylphenyl)ethyl]propanamide is sourced from PubChem (CID 48664298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).