N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide

C20H25N3O3 — CID 86924606

IUPACN-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide
SMILESCOc1ccc(C(C)N(C)CC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C20H25N3O3/c1-14(16-8-10-19(26-4)11-9-16)23(3)13-20(25)22-18-7-5-6-17(12-18)21-15(2)24/h5-12,14H,13H2,1-4H3,(H,21,24)(H,22,25)
InChIKeyCCMMZXCGRCVRIV-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.29
Rot. Bonds7

About N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide

N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide (PubChem CID 86924606) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide.

Molecular Properties

Compound NameN-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide
PubChem CID86924606
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC NameN-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide
SMILESCOc1ccc(C(C)N(C)CC(=O)Nc2cccc(NC(C)=O)c2)cc1
InChIInChI=1S/C20H25N3O3/c1-14(16-8-10-19(26-4)11-9-16)23(3)13-20(25)22-18-7-5-6-17(12-18)21-15(2)24/h5-12,14H,13H2,1-4H3,(H,21,24)(H,22,25)
InChIKeyCCMMZXCGRCVRIV-UHFFFAOYSA-N
XLogP3.29
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-2-[[(1R)-1-(4-fluorophenyl)ethyl]-methylamino]acetamide
CID 8846327
2-[methyl(1-phenylethyl)amino]-N-phenylacetamide
CID 47109719
2-[[2-hydroxy-1-(4-methoxyphenyl)ethyl]-methylamino]-N-phenylacetamide
CID 111122600
(3S)-N-(3-acetamidophenyl)-3-[benzenesulfonyl(methyl)amino]-3-(4-methoxyphenyl)propanamide
CID 92648099
N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide
CID 78901140
N-(3-acetamidophenyl)-2-[cyclopropyl-[(4-methoxyphenyl)methyl]amino]acetamide
CID 86908948
2-[1-(4-methoxyphenyl)ethyl-methylamino]-N-[2-(trifluoromethyl)-3H-benzimidazol-5-yl]acetamide
CID 55829867
(2R)-2-[[2-(3-methoxyanilino)-2-oxoethyl]-methylamino]-N,N-dimethylpropanamide
CID 8555923
N-(3-acetamidophenyl)-2-(4-methoxyanilino)acetamide
CID 39453688
2-[[2-[1-(4-methoxyphenyl)ethyl-methylamino]acetyl]amino]-N-methyl-2-phenylacetamide
CID 87015978
N-(3-acetamidophenyl)-3-(4-methoxyphenyl)propanamide
CID 2671013
N-(3-acetamidophenyl)-2-[1-(1,3-benzothiazol-2-yl)ethyl-methylamino]acetamide
CID 17432999

Frequently Asked Questions

What is the IUPAC name of N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide?
The IUPAC name of N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide (CID 86924606) is N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide.
What is the SMILES notation for N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide?
The canonical SMILES for N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide is COc1ccc(C(C)N(C)CC(=O)Nc2cccc(NC(C)=O)c2)cc1.
What is the InChIKey of N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide?
The InChIKey is CCMMZXCGRCVRIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-14(16-8-10-19(26-4)11-9-16)23(3)13-20(25)22-18-7-5-6-17(12-18)21-15(2)24/h5-12,14H,13H2,1-4H3,(H,21,24)(H,22,25).
What are the key properties of N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide?
N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide has a molecular weight of 355.44 g/mol, XLogP of 3.29, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide is sourced from PubChem (CID 86924606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).