N-(3-cyclopropyloxy-4-ethylphenyl)acetamide

C13H17NO2 — CID 59026368

IUPACN-(3-cyclopropyloxy-4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(C)=O)cc1OC1CC1
InChIInChI=1S/C13H17NO2/c1-3-10-4-5-11(14-9(2)15)8-13(10)16-12-6-7-12/h4-5,8,12H,3,6-7H2,1-2H3,(H,14,15)
InChIKeyOPFMFVGGTUVBSQ-UHFFFAOYSA-N
MW219.28 g/mol
LogP2.75
Rot. Bonds4

About N-(3-cyclopropyloxy-4-ethylphenyl)acetamide

N-(3-cyclopropyloxy-4-ethylphenyl)acetamide (PubChem CID 59026368) has the molecular formula C13H17NO2 and a molecular weight of 219.28 g/mol. Its IUPAC name is N-(3-cyclopropyloxy-4-ethylphenyl)acetamide.

Molecular Properties

Compound NameN-(3-cyclopropyloxy-4-ethylphenyl)acetamide
PubChem CID59026368
Molecular FormulaC13H17NO2
Molecular Weight219.28 g/mol
Exact Mass219.13
IUPAC NameN-(3-cyclopropyloxy-4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(C)=O)cc1OC1CC1
InChIInChI=1S/C13H17NO2/c1-3-10-4-5-11(14-9(2)15)8-13(10)16-12-6-7-12/h4-5,8,12H,3,6-7H2,1-2H3,(H,14,15)
InChIKeyOPFMFVGGTUVBSQ-UHFFFAOYSA-N
XLogP2.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-cyclopropyloxy-4-ethylphenyl)acetamide?
The IUPAC name of N-(3-cyclopropyloxy-4-ethylphenyl)acetamide (CID 59026368) is N-(3-cyclopropyloxy-4-ethylphenyl)acetamide.
What is the SMILES notation for N-(3-cyclopropyloxy-4-ethylphenyl)acetamide?
The canonical SMILES for N-(3-cyclopropyloxy-4-ethylphenyl)acetamide is CCc1ccc(NC(C)=O)cc1OC1CC1.
What is the InChIKey of N-(3-cyclopropyloxy-4-ethylphenyl)acetamide?
The InChIKey is OPFMFVGGTUVBSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO2/c1-3-10-4-5-11(14-9(2)15)8-13(10)16-12-6-7-12/h4-5,8,12H,3,6-7H2,1-2H3,(H,14,15).
What are the key properties of N-(3-cyclopropyloxy-4-ethylphenyl)acetamide?
N-(3-cyclopropyloxy-4-ethylphenyl)acetamide has a molecular weight of 219.28 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-cyclopropyloxy-4-ethylphenyl)acetamide is sourced from PubChem (CID 59026368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).