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

C16H24N2O3 — CID 60908010

IUPAC2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
SMILESCCC(N)Cc1ccc(OCC(=O)NC2CC2)c(OC)c1
InChIInChI=1S/C16H24N2O3/c1-3-12(17)8-11-4-7-14(15(9-11)20-2)21-10-16(19)18-13-5-6-13/h4,7,9,12-13H,3,5-6,8,10,17H2,1-2H3,(H,18,19)
InChIKeyJVFRRNHCNABKGP-UHFFFAOYSA-N
MW292.38 g/mol
LogP1.63
Rot. Bonds8

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

2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide (PubChem CID 60908010) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide.

Molecular Properties

Compound Name2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
PubChem CID60908010
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
SMILESCCC(N)Cc1ccc(OCC(=O)NC2CC2)c(OC)c1
InChIInChI=1S/C16H24N2O3/c1-3-12(17)8-11-4-7-14(15(9-11)20-2)21-10-16(19)18-13-5-6-13/h4,7,9,12-13H,3,5-6,8,10,17H2,1-2H3,(H,18,19)
InChIKeyJVFRRNHCNABKGP-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

Analyze 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[5-(2-aminopropyl)-2-methoxyphenoxy]-N-cyclopropylacetamide
CID 60908147
2-[4-(2-aminopropyl)-2-ethoxyphenoxy]-N-cyclopropylacetamide
CID 60907117
2-[2-(2-aminobutyl)-4-fluorophenoxy]-N-cyclopropylacetamide
CID 107701396
2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-(4-methoxyphenyl)acetamide
CID 170889603
N-cyclopropyl-2-[4-[(1S)-1-hydroxyethyl]-2-methoxyphenoxy]acetamide
CID 78931618
ethyl 2-[4-(2-aminobutyl)-2-methoxyphenoxy]acetate
CID 60906795
N-cyclopropyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
CID 43416729
N-cyclopropyl-2-(2-methoxy-4-propan-2-ylphenoxy)acetamide
CID 177158445
N-cyclopropyl-2-[2-methoxy-4-[1-(methylamino)ethyl]phenoxy]acetamide
CID 43279426
2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-(2-chlorophenyl)acetamide;hydrochloride
CID 170889634
N-cyclopentyl-2-[4-(1-hydroxyethyl)-2-methoxyphenoxy]acetamide
CID 43416744
N-cyclopropyl-2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]acetamide
CID 7973430

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide?
The IUPAC name of 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide (CID 60908010) is 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide.
What is the SMILES notation for 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide?
The canonical SMILES for 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide is CCC(N)Cc1ccc(OCC(=O)NC2CC2)c(OC)c1.
What is the InChIKey of 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide?
The InChIKey is JVFRRNHCNABKGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-3-12(17)8-11-4-7-14(15(9-11)20-2)21-10-16(19)18-13-5-6-13/h4,7,9,12-13H,3,5-6,8,10,17H2,1-2H3,(H,18,19).
What are the key properties of 2-[4-(2-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide?
2-[4-(2-aminobutyl)-2-methoxyphenoxy]-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-aminobutyl)-2-methoxyphenoxy]-N-cyclopropylacetamide is sourced from PubChem (CID 60908010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).