2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide

C16H22N2O3 — CID 113164478

IUPAC2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide
SMILESCOc1ccccc1CCN(CC(=O)NC1CC1)C(C)=O
InChIInChI=1S/C16H22N2O3/c1-12(19)18(11-16(20)17-14-7-8-14)10-9-13-5-3-4-6-15(13)21-2/h3-6,14H,7-11H2,1-2H3,(H,17,20)
InChIKeyFFIWCWONKOEXRF-UHFFFAOYSA-N
MW290.36 g/mol
LogP1.36
Rot. Bonds7

About 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide

2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide (PubChem CID 113164478) has the molecular formula C16H22N2O3 and a molecular weight of 290.36 g/mol. Its IUPAC name is 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide
PubChem CID113164478
Molecular FormulaC16H22N2O3
Molecular Weight290.36 g/mol
Exact Mass290.16
IUPAC Name2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide
SMILESCOc1ccccc1CCN(CC(=O)NC1CC1)C(C)=O
InChIInChI=1S/C16H22N2O3/c1-12(19)18(11-16(20)17-14-7-8-14)10-9-13-5-3-4-6-15(13)21-2/h3-6,14H,7-11H2,1-2H3,(H,17,20)
InChIKeyFFIWCWONKOEXRF-UHFFFAOYSA-N
XLogP1.36
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.36
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-cycloheptylacetamide
CID 113162917
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2-methylphenyl)acetamide
CID 113164550
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(4-methylphenyl)acetamide
CID 113164552
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-[3-(dimethylamino)propyl]acetamide
CID 113164495
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-[(2-chlorophenyl)methyl]acetamide
CID 113164509
N-cyclohexyl-2-[2-(2-methoxyphenyl)ethyl-methylsulfonylamino]acetamide
CID 113152119
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2-propan-2-yloxyphenyl)acetamide
CID 113164592
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-[2-(trifluoromethyl)phenyl]acetamide
CID 113164597
4-[[2-[acetyl(2-phenylethyl)amino]acetyl]amino]cyclohexane-1-carboxylic acid
CID 120524552
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(4-cyanophenyl)acetamide
CID 113164626
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2,3,4-trifluorophenyl)acetamide
CID 113164628
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-(2,5-dimethylphenyl)acetamide
CID 113164557

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide?
The IUPAC name of 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide (CID 113164478) is 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide?
The canonical SMILES for 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide is COc1ccccc1CCN(CC(=O)NC1CC1)C(C)=O.
What is the InChIKey of 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide?
The InChIKey is FFIWCWONKOEXRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O3/c1-12(19)18(11-16(20)17-14-7-8-14)10-9-13-5-3-4-6-15(13)21-2/h3-6,14H,7-11H2,1-2H3,(H,17,20).
What are the key properties of 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide?
2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide has a molecular weight of 290.36 g/mol, XLogP of 1.36, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl-[2-(2-methoxyphenyl)ethyl]amino]-N-cyclopropylacetamide is sourced from PubChem (CID 113164478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).