3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide

C20H25N3O3 — CID 109039568

IUPAC3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide
SMILESCOc1cccc(NCCC(=O)Nc2ccccc2N2CCOCC2)c1
InChIInChI=1S/C20H25N3O3/c1-25-17-6-4-5-16(15-17)21-10-9-20(24)22-18-7-2-3-8-19(18)23-11-13-26-14-12-23/h2-8,15,21H,9-14H2,1H3,(H,22,24)
InChIKeyMXFGCTKVVSIIRL-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.97
Rot. Bonds7

About 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide

3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide (PubChem CID 109039568) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide
PubChem CID109039568
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide
SMILESCOc1cccc(NCCC(=O)Nc2ccccc2N2CCOCC2)c1
InChIInChI=1S/C20H25N3O3/c1-25-17-6-4-5-16(15-17)21-10-9-20(24)22-18-7-2-3-8-19(18)23-11-13-26-14-12-23/h2-8,15,21H,9-14H2,1H3,(H,22,24)
InChIKeyMXFGCTKVVSIIRL-UHFFFAOYSA-N
XLogP2.97
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 ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)acetamide
CID 109009056
N-(3-methoxyphenyl)-2-[methyl-[2-(2-morpholin-4-ylanilino)-2-oxoethyl]amino]acetamide
CID 4965762
1-(3-methoxyphenyl)-3-(2-morpholin-4-ylphenyl)urea
CID 108869153
N-(2-morpholin-4-ylphenyl)-3-(2,4,6-trimethylanilino)propanamide
CID 109037056
3-(2-tert-butylanilino)-N-(2-morpholin-4-ylphenyl)propanamide
CID 109037337
3-[(2-methoxyphenyl)methylamino]-N-(2-morpholin-4-ylphenyl)propanamide
CID 109022218
5-(4-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)pentanamide
CID 110297867
N-(2-ethylphenyl)-3-(2-morpholin-4-ylanilino)propanamide
CID 109036145
3-(3-methoxyanilino)-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 109039569
2-(2-methoxyphenyl)-N-(2-morpholin-4-ylphenyl)acetamide
CID 2677631
N-(4-methoxyphenyl)-2-(2-morpholin-4-ylanilino)acetamide
CID 109009136
N-(5-methoxy-2-morpholin-4-ylphenyl)-2-phenoxyacetamide
CID 6471849

Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide (CID 109039568) is 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide is COc1cccc(NCCC(=O)Nc2ccccc2N2CCOCC2)c1.
What is the InChIKey of 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide?
The InChIKey is MXFGCTKVVSIIRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-25-17-6-4-5-16(15-17)21-10-9-20(24)22-18-7-2-3-8-19(18)23-11-13-26-14-12-23/h2-8,15,21H,9-14H2,1H3,(H,22,24).
What are the key properties of 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide?
3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide has a molecular weight of 355.44 g/mol, XLogP of 2.97, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyanilino)-N-(2-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 109039568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).