2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide

C16H25NO3 — CID 12827490

IUPAC2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide
SMILESCOCC(=O)N(c1c(C)ccc(C)c1C)C(C)COC
InChIInChI=1S/C16H25NO3/c1-11-7-8-12(2)16(14(11)4)17(13(3)9-19-5)15(18)10-20-6/h7-8,13H,9-10H2,1-6H3
InChIKeyIWRZRIRWDMMFTF-UHFFFAOYSA-N
MW279.38 g/mol
LogP2.63
Rot. Bonds6

About 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide

2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide (PubChem CID 12827490) has the molecular formula C16H25NO3 and a molecular weight of 279.38 g/mol. Its IUPAC name is 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide.

Molecular Properties

Compound Name2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide
PubChem CID12827490
Molecular FormulaC16H25NO3
Molecular Weight279.38 g/mol
Exact Mass279.18
IUPAC Name2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide
SMILESCOCC(=O)N(c1c(C)ccc(C)c1C)C(C)COC
InChIInChI=1S/C16H25NO3/c1-11-7-8-12(2)16(14(11)4)17(13(3)9-19-5)15(18)10-20-6/h7-8,13H,9-10H2,1-6H3
InChIKeyIWRZRIRWDMMFTF-UHFFFAOYSA-N
XLogP2.63
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 52.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide?
The IUPAC name of 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide (CID 12827490) is 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide.
What is the SMILES notation for 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide?
The canonical SMILES for 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide is COCC(=O)N(c1c(C)ccc(C)c1C)C(C)COC.
What is the InChIKey of 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide?
The InChIKey is IWRZRIRWDMMFTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO3/c1-11-7-8-12(2)16(14(11)4)17(13(3)9-19-5)15(18)10-20-6/h7-8,13H,9-10H2,1-6H3.
What are the key properties of 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide?
2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide has a molecular weight of 279.38 g/mol, XLogP of 2.63, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(1-methoxypropan-2-yl)-N-(2,3,6-trimethylphenyl)acetamide is sourced from PubChem (CID 12827490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).