N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide

C18H22N2O2 — CID 51159592

IUPACN-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide
SMILESCOc1ccc(C)cc1NC(=O)CCNc1ccccc1C
InChIInChI=1S/C18H22N2O2/c1-13-8-9-17(22-3)16(12-13)20-18(21)10-11-19-15-7-5-4-6-14(15)2/h4-9,12,19H,10-11H2,1-3H3,(H,20,21)
InChIKeyXNNZUAAJBNKWDL-UHFFFAOYSA-N
MW298.39 g/mol
LogP3.75
Rot. Bonds6

About N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide

N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide (PubChem CID 51159592) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide
PubChem CID51159592
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide
SMILESCOc1ccc(C)cc1NC(=O)CCNc1ccccc1C
InChIInChI=1S/C18H22N2O2/c1-13-8-9-17(22-3)16(12-13)20-18(21)10-11-19-15-7-5-4-6-14(15)2/h4-9,12,19H,10-11H2,1-3H3,(H,20,21)
InChIKeyXNNZUAAJBNKWDL-UHFFFAOYSA-N
XLogP3.75
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 53.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-ethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47882363
N-(2-methoxy-5-methylphenyl)-3-(4-methylanilino)propanamide
CID 109034471
3-(5-chloro-2-methoxyanilino)-N-(2-methylphenyl)propanamide
CID 47824653
N-(5-chloro-2-methoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47877577
2-(2,5-dimethylanilino)-N-(2-methoxyphenyl)acetamide
CID 9079653
N-(2,3-dimethylphenyl)-3-(2-methoxyanilino)propanamide
CID 8893151
N-(2-methoxy-5-methylphenyl)-3-(quinolin-8-ylamino)propanamide
CID 109040020
N,N'-bis(2-methoxy-5-methylphenyl)pentanediamide
CID 5142107
N-(4-bromo-2-methylphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 109040066
N-(5-chloro-2-methoxyphenyl)-3-(5-chloro-2-methylanilino)propanamide
CID 109038439
N-[3-(2-methoxy-5-methylanilino)-3-oxopropyl]benzamide
CID 9098271
N-(3,4-dimethoxyphenyl)-3-(2-methoxy-5-methylanilino)propanamide
CID 47076752

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide (CID 51159592) is N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide is COc1ccc(C)cc1NC(=O)CCNc1ccccc1C.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide?
The InChIKey is XNNZUAAJBNKWDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-13-8-9-17(22-3)16(12-13)20-18(21)10-11-19-15-7-5-4-6-14(15)2/h4-9,12,19H,10-11H2,1-3H3,(H,20,21).
What are the key properties of N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide?
N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide has a molecular weight of 298.39 g/mol, XLogP of 3.75, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide is sourced from PubChem (CID 51159592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).