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

C15H22N2O2 — CID 63326335

IUPAC2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
SMILESCc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1
InChIInChI=1S/C15H22N2O2/c1-10-3-6-14(12(7-10)8-11(2)16)19-9-15(18)17-13-4-5-13/h3,6-7,11,13H,4-5,8-9,16H2,1-2H3,(H,17,18)
InChIKeyUBZAKXCOMMFXMG-UHFFFAOYSA-N
MW262.35 g/mol
LogP1.54
Rot. Bonds6

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

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide (PubChem CID 63326335) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
PubChem CID63326335
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
SMILESCc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1
InChIInChI=1S/C15H22N2O2/c1-10-3-6-14(12(7-10)8-11(2)16)19-9-15(18)17-13-4-5-13/h3,6-7,11,13H,4-5,8-9,16H2,1-2H3,(H,17,18)
InChIKeyUBZAKXCOMMFXMG-UHFFFAOYSA-N
XLogP1.54
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
CID 63326156
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-cyclopropylacetamide
CID 54929439
2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
CID 60906462
N-cyclopropyl-2-[2-(hydroxymethyl)-4-methylphenoxy]acetamide
CID 63325684
2-[2-[(tert-butylamino)methyl]-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326986
2-[2-(2-aminoethyl)-4-methylphenoxy]-N-cyclohexylacetamide
CID 63325796
N-cyclopropyl-2-(2,5-dimethylphenoxy)acetamide
CID 4113350
2-[5-(2-aminopropyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908147
3-[2-(2-aminobutyl)-4-methylphenoxy]-N-cyclopropylpropanamide
CID 63326041
2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
CID 60907117
N-(4-aminocyclohexyl)-2-(2,4-dimethylphenoxy)acetamide
CID 119477487
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-butylacetamide
CID 63326072

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide?
The IUPAC name of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide (CID 63326335) is 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide?
The canonical SMILES for 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide is Cc1ccc(OCC(=O)NC2CC2)c(CC(C)N)c1.
What is the InChIKey of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide?
The InChIKey is UBZAKXCOMMFXMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-10-3-6-14(12(7-10)8-11(2)16)19-9-15(18)17-13-4-5-13/h3,6-7,11,13H,4-5,8-9,16H2,1-2H3,(H,17,18).
What are the key properties of 2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide?
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide has a molecular weight of 262.35 g/mol, XLogP of 1.54, 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-cyclopropylacetamide is sourced from PubChem (CID 63326335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).