2-(3-methoxyphenoxy)-N-propan-2-ylacetamide

C12H17NO3 — CID 4149029

IUPAC2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
SMILESCOc1cccc(OCC(=O)NC(C)C)c1
InChIInChI=1S/C12H17NO3/c1-9(2)13-12(14)8-16-11-6-4-5-10(7-11)15-3/h4-7,9H,8H2,1-3H3,(H,13,14)
InChIKeyXYOYWMNMDWALLS-UHFFFAOYSA-N
MW223.27 g/mol
LogP1.60
Rot. Bonds5

About 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide

2-(3-methoxyphenoxy)-N-propan-2-ylacetamide (PubChem CID 4149029) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
PubChem CID4149029
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC Name2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
SMILESCOc1cccc(OCC(=O)NC(C)C)c1
InChIInChI=1S/C12H17NO3/c1-9(2)13-12(14)8-16-11-6-4-5-10(7-11)15-3/h4-7,9H,8H2,1-3H3,(H,13,14)
InChIKeyXYOYWMNMDWALLS-UHFFFAOYSA-N
XLogP1.60
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-[[2-(3-methoxyphenoxy)acetyl]amino]propanoic acid
CID 7722413
2-(3-methoxyphenoxy)-N-(1-methoxypropan-2-yl)acetamide
CID 78760764
2-(3-methoxyphenoxy)-N-(1-phenylethyl)acetamide
CID 19204047
2-(3-fluorophenoxy)-N-propan-2-ylacetamide
CID 60626005
2-[ethyl-[2-(3-methoxyphenoxy)acetyl]amino]-N-propan-2-ylacetamide
CID 78767293
2-phenoxy-N-propan-2-ylacetamide
CID 3614481
N-[1-(4-bromophenyl)ethyl]-2-(3-methoxyphenoxy)acetamide
CID 78760781
2-(3-methoxyphenoxy)-N-(1-naphthalen-2-ylethyl)acetamide
CID 112779282
2-(3-methoxyphenoxy)-N-[1-(4-methylphenoxy)propan-2-yl]acetamide
CID 132651357
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-[3-[[2-(3-methoxyphenoxy)acetyl]amino]phenyl]-2-methylpropanamide
CID 87016346
N-(1-cyclohexyl-3-hydroxypropyl)-2-(3-methoxyphenoxy)acetamide
CID 75390435

Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide?
The IUPAC name of 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide (CID 4149029) is 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide.
What is the SMILES notation for 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide?
The canonical SMILES for 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide is COc1cccc(OCC(=O)NC(C)C)c1.
What is the InChIKey of 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide?
The InChIKey is XYOYWMNMDWALLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO3/c1-9(2)13-12(14)8-16-11-6-4-5-10(7-11)15-3/h4-7,9H,8H2,1-3H3,(H,13,14).
What are the key properties of 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide?
2-(3-methoxyphenoxy)-N-propan-2-ylacetamide has a molecular weight of 223.27 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenoxy)-N-propan-2-ylacetamide is sourced from PubChem (CID 4149029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).