2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide

C13H19NO3 — CID 61062328

IUPAC2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide
SMILESCCCOc1cc(C)ccc1NC(=O)COC
InChIInChI=1S/C13H19NO3/c1-4-7-17-12-8-10(2)5-6-11(12)14-13(15)9-16-3/h5-6,8H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyPLKMURNDLZOGGO-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.37
Rot. Bonds6

About 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide

2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide (PubChem CID 61062328) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide
PubChem CID61062328
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC Name2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide
SMILESCCCOc1cc(C)ccc1NC(=O)COC
InChIInChI=1S/C13H19NO3/c1-4-7-17-12-8-10(2)5-6-11(12)14-13(15)9-16-3/h5-6,8H,4,7,9H2,1-3H3,(H,14,15)
InChIKeyPLKMURNDLZOGGO-UHFFFAOYSA-N
XLogP2.37
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide?
The IUPAC name of 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide (CID 61062328) is 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide.
What is the SMILES notation for 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide?
The canonical SMILES for 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide is CCCOc1cc(C)ccc1NC(=O)COC.
What is the InChIKey of 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide?
The InChIKey is PLKMURNDLZOGGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-4-7-17-12-8-10(2)5-6-11(12)14-13(15)9-16-3/h5-6,8H,4,7,9H2,1-3H3,(H,14,15).
What are the key properties of 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide?
2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide has a molecular weight of 237.30 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(4-methyl-2-propoxyphenyl)acetamide is sourced from PubChem (CID 61062328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).