2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide

C17H26N2O2 — CID 63326156

IUPAC2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
SMILESCc1ccc(OCC(=O)NC2CCCC2)c(CC(C)N)c1
InChIInChI=1S/C17H26N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-17(20)19-15-5-3-4-6-15/h7-9,13,15H,3-6,10-11,18H2,1-2H3,(H,19,20)
InChIKeyUZUYXXURJJUQMY-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.32
Rot. Bonds6

About 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide (PubChem CID 63326156) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
PubChem CID63326156
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
SMILESCc1ccc(OCC(=O)NC2CCCC2)c(CC(C)N)c1
InChIInChI=1S/C17H26N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-17(20)19-15-5-3-4-6-15/h7-9,13,15H,3-6,10-11,18H2,1-2H3,(H,19,20)
InChIKeyUZUYXXURJJUQMY-UHFFFAOYSA-N
XLogP2.32
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326335
2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
CID 60906462
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-cyclopropylacetamide
CID 54929439
2-[2-(2-aminoethyl)-4-methylphenoxy]-N-cyclohexylacetamide
CID 63325796
N-cyclopropyl-2-[2-(hydroxymethyl)-4-methylphenoxy]acetamide
CID 63325684
N-cyclopentyl-2-[2-[(1R)-1-hydroxyethyl]-4-methylphenoxy]acetamide
CID 63366475
N-cyclohexyl-2-(5-methyl-2-propan-2-ylphenoxy)acetamide
CID 94840112
2-[2-(2-aminopropyl)-6-methylphenoxy]-N-cyclopentylacetamide
CID 115958124
2-[2-[(tert-butylamino)methyl]-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326986
N-cyclopentyl-2-(2-formyl-4-methylphenoxy)acetamide
CID 63324573
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-butylacetamide
CID 63326072
2-[2-(hydroxymethyl)-4-methylphenoxy]-N-(oxan-4-yl)acetamide
CID 63325624

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide?
The IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide (CID 63326156) is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide?
The canonical SMILES for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide is Cc1ccc(OCC(=O)NC2CCCC2)c(CC(C)N)c1.
What is the InChIKey of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide?
The InChIKey is UZUYXXURJJUQMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-12-7-8-16(14(9-12)10-13(2)18)21-11-17(20)19-15-5-3-4-6-15/h7-9,13,15H,3-6,10-11,18H2,1-2H3,(H,19,20).
What are the key properties of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide?
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide has a molecular weight of 290.41 g/mol, XLogP of 2.32, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide is sourced from PubChem (CID 63326156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).