N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide

C20H26N2O3 — CID 78901140

IUPACN-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)C(C)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C20H26N2O3/c1-14-6-8-16(9-7-14)15(2)22(3)13-20(23)21-17-10-11-18(24-4)19(12-17)25-5/h6-12,15H,13H2,1-5H3,(H,21,23)
InChIKeyPHXYEDVCAARAHJ-UHFFFAOYSA-N
MW342.44 g/mol
LogP3.64
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide

N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide (PubChem CID 78901140) has the molecular formula C20H26N2O3 and a molecular weight of 342.44 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide
PubChem CID78901140
Molecular FormulaC20H26N2O3
Molecular Weight342.44 g/mol
Exact Mass342.19
IUPAC NameN-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide
SMILESCOc1ccc(NC(=O)CN(C)C(C)c2ccc(C)cc2)cc1OC
InChIInChI=1S/C20H26N2O3/c1-14-6-8-16(9-7-14)15(2)22(3)13-20(23)21-17-10-11-18(24-4)19(12-17)25-5/h6-12,15H,13H2,1-5H3,(H,21,23)
InChIKeyPHXYEDVCAARAHJ-UHFFFAOYSA-N
XLogP3.64
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.44
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(N,2,4-trimethylanilino)acetamide
CID 78903073
N-(3-acetamidophenyl)-2-[1-(4-methoxyphenyl)ethyl-methylamino]acetamide
CID 86924606
2-[[(1R)-1-(1,3-benzothiazol-2-yl)ethyl]-methylamino]-N-(3,4-dimethoxyphenyl)acetamide
CID 9047691
2-[2-(3,4-dimethoxyanilino)-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide
CID 9458010
N,N'-bis(3,4-dimethoxyphenyl)propanediamide
CID 21232287
N-(3-chloro-4-methoxyphenyl)-2-[methyl-[(1S)-1-pyridin-3-ylethyl]amino]acetamide
CID 97089206
2-(diethylamino)-N-(3,4-dimethoxyphenyl)acetamide
CID 11521836
2-[1-(4-chlorophenyl)ethyl-methylamino]-N-(3,4-difluorophenyl)acetamide
CID 46573825
2-[cyclopropylmethyl(1-phenylethyl)amino]-N-(3,4-dimethoxyphenyl)acetamide
CID 86876464
N-(3,4-dimethoxyphenyl)-2-(2,4-dimethylphenyl)sulfanylacetamide
CID 2708642
N-[(3,4-dimethoxyphenyl)methyl]-2-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]acetamide
CID 8729621
(3,4-dimethoxyphenyl)methyl-methyl-[(2R)-1-[methyl-[2-(4-methylanilino)-2-oxoethyl]amino]-1-oxopropan-2-yl]azanium
CID 9058354

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide (CID 78901140) is N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide is COc1ccc(NC(=O)CN(C)C(C)c2ccc(C)cc2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide?
The InChIKey is PHXYEDVCAARAHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3/c1-14-6-8-16(9-7-14)15(2)22(3)13-20(23)21-17-10-11-18(24-4)19(12-17)25-5/h6-12,15H,13H2,1-5H3,(H,21,23).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide?
N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide has a molecular weight of 342.44 g/mol, XLogP of 3.64, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-[methyl-[1-(4-methylphenyl)ethyl]amino]acetamide is sourced from PubChem (CID 78901140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).