2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide

C20H25N3O3 — CID 2404248

IUPAC2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCOc1cccc(CNCC(=O)Nc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C20H25N3O3/c1-25-19-4-2-3-16(13-19)14-21-15-20(24)22-17-5-7-18(8-6-17)23-9-11-26-12-10-23/h2-8,13,21H,9-12,14-15H2,1H3,(H,22,24)
InChIKeyWSNBFSFNOALRNM-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.26
Rot. Bonds7

About 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide

2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 2404248) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID2404248
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCOc1cccc(CNCC(=O)Nc2ccc(N3CCOCC3)cc2)c1
InChIInChI=1S/C20H25N3O3/c1-25-19-4-2-3-16(13-19)14-21-15-20(24)22-17-5-7-18(8-6-17)23-9-11-26-12-10-23/h2-8,13,21H,9-12,14-15H2,1H3,(H,22,24)
InChIKeyWSNBFSFNOALRNM-UHFFFAOYSA-N
XLogP2.26
TPSA62.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

3-methoxy-N-(4-morpholin-4-ylphenyl)benzamide
CID 795014
3-(3-methoxyphenyl)-N-[4-(2-methylmorpholin-4-yl)phenyl]propanamide
CID 110637305
2-(ethylamino)-N-(4-morpholin-4-ylphenyl)acetamide;dihydrochloride
CID 20847919
2-[(R)-[2-(4-methoxyanilino)-2-oxoethyl]sulfinyl]-N-(4-morpholin-4-ylphenyl)acetamide
CID 51686054
[(2R)-1-(3-methoxyanilino)-1-oxopropan-2-yl]-methyl-[2-(4-morpholin-4-ylanilino)-2-oxoethyl]azanium
CID 8592727
N-(4-morpholin-4-ylphenyl)-2-(3,4,5-trimethoxyanilino)acetamide
CID 55362335
N-(4-methoxyphenyl)-2-[2-(3-methoxyphenyl)ethylamino]acetamide
CID 109000927
N-(4-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 675127
2-(1,3-benzodioxol-5-ylmethylamino)-N-(3-methoxyphenyl)acetamide
CID 108998752
2-(2-methoxy-5-methylanilino)-N-(4-morpholin-4-ylphenyl)acetamide
CID 9099925
1-[4-(4-methoxyphenyl)piperazin-1-yl]-2-[(3-methylphenyl)methylamino]ethanone
CID 108996776
2-[(3-methoxyphenyl)methylamino]acetic acid
CID 13236084

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide (CID 2404248) is 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide is COc1cccc(CNCC(=O)Nc2ccc(N3CCOCC3)cc2)c1.
What is the InChIKey of 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is WSNBFSFNOALRNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-25-19-4-2-3-16(13-19)14-21-15-20(24)22-17-5-7-18(8-6-17)23-9-11-26-12-10-23/h2-8,13,21H,9-12,14-15H2,1H3,(H,22,24).
What are the key properties of 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide?
2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 355.44 g/mol, XLogP of 2.26, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxyphenyl)methylamino]-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 2404248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).