N-(2-formyl-6-methoxy-3-methylphenyl)acetamide

C11H13NO3 — CID 84779440

IUPACN-(2-formyl-6-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(C)c(C=O)c1NC(C)=O
InChIInChI=1S/C11H13NO3/c1-7-4-5-10(15-3)11(9(7)6-13)12-8(2)14/h4-6H,1-3H3,(H,12,14)
InChIKeyLUCVLTAHQNYKOW-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.77
Rot. Bonds3

About N-(2-formyl-6-methoxy-3-methylphenyl)acetamide

N-(2-formyl-6-methoxy-3-methylphenyl)acetamide (PubChem CID 84779440) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is N-(2-formyl-6-methoxy-3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-(2-formyl-6-methoxy-3-methylphenyl)acetamide
PubChem CID84779440
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC NameN-(2-formyl-6-methoxy-3-methylphenyl)acetamide
SMILESCOc1ccc(C)c(C=O)c1NC(C)=O
InChIInChI=1S/C11H13NO3/c1-7-4-5-10(15-3)11(9(7)6-13)12-8(2)14/h4-6H,1-3H3,(H,12,14)
InChIKeyLUCVLTAHQNYKOW-UHFFFAOYSA-N
XLogP1.77
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

2-formyl-6-methoxy-3-methylbenzoyl chloride
CID 171022028
2-(2-bromoacetyl)-3-methoxy-6-methylbenzaldehyde
CID 171022450
N-(3-formyl-4-hydroxy-5-methoxy-2,6-dimethylphenyl)acetamide
CID 84798473
N-[3-bromo-6-methoxy-2-(3-oxopropyl)phenyl]acetamide
CID 117483193
N-(5-formyl-2,3-dimethoxy-6-methylphenyl)acetamide
CID 84798477
N-(2,6-difluoro-3,5-dimethoxyphenyl)acetamide
CID 150969889
N-(3-formyl-4-methyl-2-nitrosophenyl)acetamide
CID 88893373
N-(2-acetyl-6-methoxyphenyl)acetamide
CID 117295660
N-(3-acetamido-5-formyl-2,4,6-triiodophenyl)acetamide
CID 57243531
N-(3-formyl-2-methoxy-4,5-dimethylphenyl)acetamide
CID 84787877
N-(4-formyl-2-methoxy-3,6-dimethylphenyl)acetamide
CID 84787865
2-acetyl-6-iodo-3-methoxybenzaldehyde
CID 171015394

Frequently Asked Questions

What is the IUPAC name of N-(2-formyl-6-methoxy-3-methylphenyl)acetamide?
The IUPAC name of N-(2-formyl-6-methoxy-3-methylphenyl)acetamide (CID 84779440) is N-(2-formyl-6-methoxy-3-methylphenyl)acetamide.
What is the SMILES notation for N-(2-formyl-6-methoxy-3-methylphenyl)acetamide?
The canonical SMILES for N-(2-formyl-6-methoxy-3-methylphenyl)acetamide is COc1ccc(C)c(C=O)c1NC(C)=O.
What is the InChIKey of N-(2-formyl-6-methoxy-3-methylphenyl)acetamide?
The InChIKey is LUCVLTAHQNYKOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c1-7-4-5-10(15-3)11(9(7)6-13)12-8(2)14/h4-6H,1-3H3,(H,12,14).
What are the key properties of N-(2-formyl-6-methoxy-3-methylphenyl)acetamide?
N-(2-formyl-6-methoxy-3-methylphenyl)acetamide has a molecular weight of 207.23 g/mol, XLogP of 1.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-formyl-6-methoxy-3-methylphenyl)acetamide is sourced from PubChem (CID 84779440), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).