3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide

C22H30N2O3 — CID 161466164

IUPAC3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide
SMILESCCN(C)Cc1ccc(OC)cc1OCCC(=O)NCc1ccc(C)cc1
InChIInChI=1S/C22H30N2O3/c1-5-24(3)16-19-10-11-20(26-4)14-21(19)27-13-12-22(25)23-15-18-8-6-17(2)7-9-18/h6-11,14H,5,12-13,15-16H2,1-4H3,(H,23,25)
InChIKeyWCLSMKPUIVERSA-UHFFFAOYSA-N
MW370.49 g/mol
LogP3.54
Rot. Bonds10

About 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide

3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide (PubChem CID 161466164) has the molecular formula C22H30N2O3 and a molecular weight of 370.49 g/mol. Its IUPAC name is 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide
PubChem CID161466164
Molecular FormulaC22H30N2O3
Molecular Weight370.49 g/mol
Exact Mass370.23
IUPAC Name3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide
SMILESCCN(C)Cc1ccc(OC)cc1OCCC(=O)NCc1ccc(C)cc1
InChIInChI=1S/C22H30N2O3/c1-5-24(3)16-19-10-11-20(26-4)14-21(19)27-13-12-22(25)23-15-18-8-6-17(2)7-9-18/h6-11,14H,5,12-13,15-16H2,1-4H3,(H,23,25)
InChIKeyWCLSMKPUIVERSA-UHFFFAOYSA-N
XLogP3.54
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.49
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[2-[[ethyl(propyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-pentylphenyl)methyl]propanamide
CID 146282335
2-(2,4-dimethoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide
CID 9428047
3-(2,5-dimethylphenoxy)-N-[(4-methylphenyl)methyl]propanamide
CID 27259732
N-[[4-(diethylaminomethyl)phenyl]methyl]-3-(4-methoxyphenoxy)propanamide
CID 27332548
N-[(4-methoxyphenyl)methyl]-3-phenoxypropanamide
CID 26365331
2-(4-methoxyphenyl)-N-[(4-methylphenyl)methyl]acetamide;hydrochloride
CID 142729709
4-[[2-[3-(dimethylamino)propoxy]-4-methoxyphenyl]methylamino]-4-oxobutanoic acid
CID 22681936
5-(2,5-dimethylphenoxy)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]pentanamide
CID 48503193
N-ethyl-3-[2-(ethylaminomethyl)-4-methoxyphenoxy]propanamide
CID 62325462
4-methoxy-2-[2-[(4-methylphenyl)methylamino]-2-oxoethoxy]benzamide
CID 18085837
2-[(3-methoxyphenyl)methyl-methylamino]-N-[(4-methylphenyl)methyl]acetamide;oxalic acid
CID 24761813
N-[(4-butoxy-3-methoxyphenyl)methyl]-2-(2,4-dimethoxyphenyl)acetamide
CID 39971219

Frequently Asked Questions

What is the IUPAC name of 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide?
The IUPAC name of 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide (CID 161466164) is 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide.
What is the SMILES notation for 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide?
The canonical SMILES for 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide is CCN(C)Cc1ccc(OC)cc1OCCC(=O)NCc1ccc(C)cc1.
What is the InChIKey of 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide?
The InChIKey is WCLSMKPUIVERSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N2O3/c1-5-24(3)16-19-10-11-20(26-4)14-21(19)27-13-12-22(25)23-15-18-8-6-17(2)7-9-18/h6-11,14H,5,12-13,15-16H2,1-4H3,(H,23,25).
What are the key properties of 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide?
3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide has a molecular weight of 370.49 g/mol, XLogP of 3.54, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[[ethyl(methyl)amino]methyl]-5-methoxyphenoxy]-N-[(4-methylphenyl)methyl]propanamide is sourced from PubChem (CID 161466164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).