2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide

C15H22N2O3 — CID 60906462

IUPAC2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
SMILESCOc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1
InChIInChI=1S/C15H22N2O3/c1-10(16)7-11-8-13(19-2)5-6-14(11)20-9-15(18)17-12-3-4-12/h5-6,8,10,12H,3-4,7,9,16H2,1-2H3,(H,17,18)
InChIKeyXBGPJGCODAYKFL-UHFFFAOYSA-N
MW278.35 g/mol
LogP1.24
Rot. Bonds7

About 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide

2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide (PubChem CID 60906462) has the molecular formula C15H22N2O3 and a molecular weight of 278.35 g/mol. Its IUPAC name is 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
PubChem CID60906462
Molecular FormulaC15H22N2O3
Molecular Weight278.35 g/mol
Exact Mass278.16
IUPAC Name2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
SMILESCOc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1
InChIInChI=1S/C15H22N2O3/c1-10(16)7-11-8-13(19-2)5-6-14(11)20-9-15(18)17-12-3-4-12/h5-6,8,10,12H,3-4,7,9,16H2,1-2H3,(H,17,18)
InChIKeyXBGPJGCODAYKFL-UHFFFAOYSA-N
XLogP1.24
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.35
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326335
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-cyclopropylacetamide
CID 54929439
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
CID 63326156
2-[5-(2-aminopropyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908147
methyl 2-[2-(2-aminopropyl)-4-methoxyphenoxy]acetate
CID 54930741
N-cyclopropyl-2-[2-[(1R)-1-hydroxyethyl]-5-methoxyphenoxy]acetamide
CID 82001807
2-(2-bromo-4-methoxyphenoxy)-N-cycloheptylacetamide
CID 104704670
2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
CID 60907117
2-[2-(2-aminobutyl)-4-fluorophenoxy]-N-cyclopropylacetamide
CID 107701396
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
N-(4-aminocyclohexyl)-2-(2,5-dimethoxyphenyl)acetamide
CID 119476462
N-cyclopropyl-2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]acetamide
CID 78931618

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide?
The IUPAC name of 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide (CID 60906462) is 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide?
The canonical SMILES for 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide is COc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1.
What is the InChIKey of 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide?
The InChIKey is XBGPJGCODAYKFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O3/c1-10(16)7-11-8-13(19-2)5-6-14(11)20-9-15(18)17-12-3-4-12/h5-6,8,10,12H,3-4,7,9,16H2,1-2H3,(H,17,18).
What are the key properties of 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide?
2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide has a molecular weight of 278.35 g/mol, XLogP of 1.24, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide is sourced from PubChem (CID 60906462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).