N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide

C14H22N2O2 — CID 110838289

IUPACN-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide
SMILESCNC(C)(C)CC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C14H22N2O2/c1-10-6-7-12(18-5)11(8-10)16-13(17)9-14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17)
InChIKeyLASDKBDJAFLCSS-UHFFFAOYSA-N
MW250.34 g/mol
LogP2.33
Rot. Bonds5

About N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide

N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide (PubChem CID 110838289) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide
PubChem CID110838289
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC NameN-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide
SMILESCNC(C)(C)CC(=O)Nc1cc(C)ccc1OC
InChIInChI=1S/C14H22N2O2/c1-10-6-7-12(18-5)11(8-10)16-13(17)9-14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17)
InChIKeyLASDKBDJAFLCSS-UHFFFAOYSA-N
XLogP2.33
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 52.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4,4,4-trifluoro-3-hydroxy-N-(2-methoxy-5-methylphenyl)-3-(trifluoromethyl)butanamide
CID 823256
N,N'-bis(2-methoxy-5-methylphenyl)pentanediamide
CID 5142107
2-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide
CID 1447930
N-(2-methoxy-5-methylphenyl)-4-oxopentanamide
CID 60636995
N'-(2,5-dimethoxyphenyl)-N-(2-methoxy-5-methylphenyl)propanediamide
CID 108955778
ethyl 2-hydroxy-4-(2-methoxy-5-methylanilino)-4-oxo-2-(trifluoromethyl)butanoate
CID 19578934
N-(2-methoxy-5-methylphenyl)-3-(4-methylanilino)propanamide
CID 109034471
N-(2-methoxy-5-methylphenyl)-3-(2-methylanilino)propanamide
CID 51159592
N-(2-methoxy-5-methylphenyl)-2-nitroacetamide
CID 21322087
N-(2-methoxy-5-methylphenyl)-2-propan-2-yloxyacetamide
CID 47410584
4-amino-N-(2-methoxy-5-methylphenyl)-4-sulfanylidenebutanamide
CID 94270072
2-(3,5-dimethoxyphenoxy)-N-(2-methoxy-5-methylphenyl)acetamide
CID 7707192

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide (CID 110838289) is N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide is CNC(C)(C)CC(=O)Nc1cc(C)ccc1OC.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide?
The InChIKey is LASDKBDJAFLCSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-6-7-12(18-5)11(8-10)16-13(17)9-14(2,3)15-4/h6-8,15H,9H2,1-5H3,(H,16,17).
What are the key properties of N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide?
N-(2-methoxy-5-methylphenyl)-3-methyl-3-(methylamino)butanamide has a molecular weight of 250.34 g/mol, XLogP of 2.33, 5 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-methyl-3-(methylamino)butanamide is sourced from PubChem (CID 110838289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).