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

C16H24N2O3 — CID 60907117

IUPAC2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
SMILESCCOc1cc(CC(C)N)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C16H24N2O3/c1-3-20-15-9-12(8-11(2)17)4-7-14(15)21-10-16(19)18-13-5-6-13/h4,7,9,11,13H,3,5-6,8,10,17H2,1-2H3,(H,18,19)
InChIKeyJUSLHDOTYYQAGU-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.63
Rot. Bonds8

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

2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide (PubChem CID 60907117) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
PubChem CID60907117
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
SMILESCCOc1cc(CC(C)N)ccc1OCC(=O)NC1CC1
InChIInChI=1S/C16H24N2O3/c1-3-20-15-9-12(8-11(2)17)4-7-14(15)21-10-16(19)18-13-5-6-13/h4,7,9,11,13H,3,5-6,8,10,17H2,1-2H3,(H,18,19)
InChIKeyJUSLHDOTYYQAGU-UHFFFAOYSA-N
XLogP1.63
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 51.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(2-aminopropyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908147
2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908010
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopropylacetamide
CID 63326335
2-[4-(2-aminopropyl)-2,6-dibromophenoxy]-N-cyclopropylacetamide
CID 107739745
2-[2-(2-aminopropyl)-4-chlorophenoxy]-N-cyclopropylacetamide
CID 54929439
2-[2-(2-aminopropyl)-4-methoxyphenoxy]-N-cyclopropylacetamide
CID 60906462
2-[2-(2-aminopropyl)-4-methylphenoxy]-N-cyclopentylacetamide
CID 63326156
1-[3-ethoxy-4-(2-methylidenebutoxy)phenyl]propan-2-amine
CID 66039251
1-[4-(cyclopentylmethoxy)-3-ethoxyphenyl]propan-2-amine
CID 61342843
1-[3-ethoxy-4-(3-ethoxypropoxy)phenyl]propan-2-amine
CID 65181053
methyl 3-[4-(2-aminopropyl)-2-ethoxyphenoxy]propanoate
CID 63947485
[2-[(4-methylcyclohexyl)amino]-2-oxoethyl] 3,4-diethoxybenzoate
CID 7042976

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide (CID 60907117) is 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide is CCOc1cc(CC(C)N)ccc1OCC(=O)NC1CC1.
What is the InChIKey of 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide?
The InChIKey is JUSLHDOTYYQAGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-20-15-9-12(8-11(2)17)4-7-14(15)21-10-16(19)18-13-5-6-13/h4,7,9,11,13H,3,5-6,8,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide?
2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide has a molecular weight of 292.38 g/mol, XLogP of 1.63, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide is sourced from PubChem (CID 60907117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).