N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide

C18H21NO3 — CID 46590423

IUPACN-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide
SMILESCOc1cccc(CNC(=O)Cc2ccccc2C)c1OC
InChIInChI=1S/C18H21NO3/c1-13-7-4-5-8-14(13)11-17(20)19-12-15-9-6-10-16(21-2)18(15)22-3/h4-10H,11-12H2,1-3H3,(H,19,20)
InChIKeyZPBZPCRPTFMJIT-UHFFFAOYSA-N
MW299.37 g/mol
LogP2.87
Rot. Bonds6

About N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide

N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide (PubChem CID 46590423) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide
PubChem CID46590423
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC NameN-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide
SMILESCOc1cccc(CNC(=O)Cc2ccccc2C)c1OC
InChIInChI=1S/C18H21NO3/c1-13-7-4-5-8-14(13)11-17(20)19-12-15-9-6-10-16(21-2)18(15)22-3/h4-10H,11-12H2,1-3H3,(H,19,20)
InChIKeyZPBZPCRPTFMJIT-UHFFFAOYSA-N
XLogP2.87
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(2,4-dimethoxy-3-methylphenyl)methyl]-2-(2-methylphenyl)acetamide
CID 110783236
N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)sulfanylacetamide
CID 46586301
N-[(2,3-dimethoxyphenyl)methyl]-2-(4-methoxyphenyl)acetamide
CID 46590636
N-[(2,3-dimethoxyphenyl)methyl]-2-methoxyacetamide
CID 47161214
[2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2,3-dimethoxybenzoate
CID 9203446
N-[(2,3-dimethoxyphenyl)methyl]naphthalene-1-carboxamide
CID 46590604
2-(2-methoxy-5-methylphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 9184395
2-[(2-methoxyphenyl)methylamino]-N-[(2-methylphenyl)methyl]acetamide
CID 108996645
2-(2-methylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 94043014
2,3-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 912335
2-amino-6-methoxy-N-[(2-methylphenyl)methyl]benzamide
CID 81421054
2-(2,5-dimethoxyphenyl)-N-[(2-methylphenyl)methyl]acetamide
CID 78806562

Frequently Asked Questions

What is the IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide?
The IUPAC name of N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide (CID 46590423) is N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide?
The canonical SMILES for N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide is COc1cccc(CNC(=O)Cc2ccccc2C)c1OC.
What is the InChIKey of N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide?
The InChIKey is ZPBZPCRPTFMJIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13-7-4-5-8-14(13)11-17(20)19-12-15-9-6-10-16(21-2)18(15)22-3/h4-10H,11-12H2,1-3H3,(H,19,20).
What are the key properties of N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide?
N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide has a molecular weight of 299.37 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2,3-dimethoxyphenyl)methyl]-2-(2-methylphenyl)acetamide is sourced from PubChem (CID 46590423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).