2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide

C14H21NO3 — CID 110763321

IUPAC2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)C)c(OC)c1C
InChIInChI=1S/C14H21NO3/c1-9(2)8-15-14(16)11-6-7-12(17-4)10(3)13(11)18-5/h6-7,9H,8H2,1-5H3,(H,15,16)
InChIKeySZOGGVHILKUEJX-UHFFFAOYSA-N
MW251.33 g/mol
LogP2.40
Rot. Bonds5

About 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide

2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide (PubChem CID 110763321) has the molecular formula C14H21NO3 and a molecular weight of 251.33 g/mol. Its IUPAC name is 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide
PubChem CID110763321
Molecular FormulaC14H21NO3
Molecular Weight251.33 g/mol
Exact Mass251.15
IUPAC Name2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide
SMILESCOc1ccc(C(=O)NCC(C)C)c(OC)c1C
InChIInChI=1S/C14H21NO3/c1-9(2)8-15-14(16)11-6-7-12(17-4)10(3)13(11)18-5/h6-7,9H,8H2,1-5H3,(H,15,16)
InChIKeySZOGGVHILKUEJX-UHFFFAOYSA-N
XLogP2.40
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide 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

N-(3-hydroxypropyl)-2,4-dimethoxy-3-methylbenzamide
CID 98016459
2,4-dimethoxy-3-methyl-N-prop-2-enylbenzamide
CID 110763319
N-[(2S)-2-hydroxypropyl]-2,3,4-trimethoxybenzamide
CID 83030336
2,4-dimethoxy-3-methyl-N-[(4-methylphenyl)methyl]benzamide
CID 110763344
N-(3-amino-2-methylpropyl)-4-methoxy-2,3-dimethylbenzamide
CID 115271620
N-(3-chloro-2-methylpropyl)-2,3,4-trimethoxybenzamide
CID 114302515
2-methoxy-N-(2-methylpropyl)-4-propan-2-ylbenzamide
CID 110762907
2,4-dimethoxy-3-methyl-N-[(3-methylphenyl)methyl]benzamide
CID 110763343
N-(4-acetamidophenyl)-2,4-dimethoxy-3-methylbenzamide
CID 110763407
2-(difluoromethoxy)-3-methoxy-N-(2-methylpropyl)benzamide
CID 134059564
2-bromo-1-(2,4-dimethoxy-3-methylphenyl)propan-1-one
CID 14199715
2,3,4-trimethoxy-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598793

Frequently Asked Questions

What is the IUPAC name of 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide?
The IUPAC name of 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide (CID 110763321) is 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide?
The canonical SMILES for 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide is COc1ccc(C(=O)NCC(C)C)c(OC)c1C.
What is the InChIKey of 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide?
The InChIKey is SZOGGVHILKUEJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO3/c1-9(2)8-15-14(16)11-6-7-12(17-4)10(3)13(11)18-5/h6-7,9H,8H2,1-5H3,(H,15,16).
What are the key properties of 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide?
2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide has a molecular weight of 251.33 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethoxy-3-methyl-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 110763321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).