3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide

C19H24N2O3 — CID 47877777

IUPAC3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)CCNc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-14-4-9-18(24-3)17(12-14)20-11-10-19(22)21-13-15-5-7-16(23-2)8-6-15/h4-9,12,20H,10-11,13H2,1-3H3,(H,21,22)
InChIKeyWLPWHAPGUMSFGN-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.13
Rot. Bonds8

About 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide

3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide (PubChem CID 47877777) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide.

Molecular Properties

Compound Name3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide
PubChem CID47877777
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide
SMILESCOc1ccc(CNC(=O)CCNc2cc(C)ccc2OC)cc1
InChIInChI=1S/C19H24N2O3/c1-14-4-9-18(24-3)17(12-14)20-11-10-19(22)21-13-15-5-7-16(23-2)8-6-15/h4-9,12,20H,10-11,13H2,1-3H3,(H,21,22)
InChIKeyWLPWHAPGUMSFGN-UHFFFAOYSA-N
XLogP3.13
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2,5-dimethoxyanilino)-N-[(4-methoxyphenyl)methyl]propanamide
CID 109022353
3-(2,5-dimethoxyanilino)-N-[(3,4-dimethoxyphenyl)methyl]propanamide
CID 109028189
3-(2-methoxy-5-methylanilino)-N-(4-methoxyphenyl)propanamide
CID 47877564
N-[(4-methoxyphenyl)methyl]-3-(4-methylanilino)propanamide
CID 8833236
N'-(2,5-dimethylphenyl)-N-[(4-methoxyphenyl)methyl]propanediamide
CID 108947053
N-[(3,4-dimethoxyphenyl)methyl]-3-[(4-methoxyphenyl)methylamino]propanamide
CID 109022434
N-benzyl-3-(2-methoxyanilino)propanamide
CID 109018840
3-(2,5-dimethoxyanilino)-N-[(2-methylphenyl)methyl]propanamide
CID 109019183
N-[2-(4-chlorophenyl)ethyl]-3-(2,5-dimethoxyanilino)propanamide
CID 109027954
N-(3,4-dimethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47076752
3-(2,5-dimethylanilino)-N-[(2-methoxyphenyl)methyl]propanamide
CID 109022003
2-[(2-methoxy-5-methylphenyl)sulfonyl-methylamino]-N-[(4-methoxyphenyl)methyl]acetamide
CID 1294275

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide?
The IUPAC name of 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide (CID 47877777) is 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide.
What is the SMILES notation for 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide?
The canonical SMILES for 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide is COc1ccc(CNC(=O)CCNc2cc(C)ccc2OC)cc1.
What is the InChIKey of 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide?
The InChIKey is WLPWHAPGUMSFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-14-4-9-18(24-3)17(12-14)20-11-10-19(22)21-13-15-5-7-16(23-2)8-6-15/h4-9,12,20H,10-11,13H2,1-3H3,(H,21,22).
What are the key properties of 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide?
3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide has a molecular weight of 328.41 g/mol, XLogP of 3.13, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxy-5-methylanilino)-N-[(4-methoxyphenyl)methyl]propanamide is sourced from PubChem (CID 47877777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).