2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide

C16H24N2O3 — CID 63095853

IUPAC2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)COc1ccc2c(c1)OCC2NC
InChIInChI=1S/C16H24N2O3/c1-4-11(5-2)18-16(19)10-20-12-6-7-13-14(17-3)9-21-15(13)8-12/h6-8,11,14,17H,4-5,9-10H2,1-3H3,(H,18,19)
InChIKeyHVAJIOZLUWGTQG-UHFFFAOYSA-N
MW292.38 g/mol
LogP2.02
Rot. Bonds7

About 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide

2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide (PubChem CID 63095853) has the molecular formula C16H24N2O3 and a molecular weight of 292.38 g/mol. Its IUPAC name is 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide.

Molecular Properties

Compound Name2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide
PubChem CID63095853
Molecular FormulaC16H24N2O3
Molecular Weight292.38 g/mol
Exact Mass292.18
IUPAC Name2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide
SMILESCCC(CC)NC(=O)COc1ccc2c(c1)OCC2NC
InChIInChI=1S/C16H24N2O3/c1-4-11(5-2)18-16(19)10-20-12-6-7-13-14(17-3)9-21-15(13)8-12/h6-8,11,14,17H,4-5,9-10H2,1-3H3,(H,18,19)
InChIKeyHVAJIOZLUWGTQG-UHFFFAOYSA-N
XLogP2.02
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclopentyl-2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]acetamide
CID 63096038
ethyl 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]acetate
CID 63094984
N-methyl-6-(2-methylidenebutoxy)-2,3-dihydro-1-benzofuran-3-amine
CID 66044717
N-methyl-6-propoxy-2,3-dihydro-1-benzofuran-3-amine
CID 63095165
2-[[3-(ethylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-propylacetamide
CID 63094817
4-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]butan-2-ol
CID 113398857
N-methyl-6-propan-2-yloxy-2,3-dihydro-1-benzofuran-3-amine
CID 63096218
N-butyl-2-[[3-(ethylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]acetamide
CID 63097450
2-naphthalen-2-yloxy-N-pentan-3-ylacetamide
CID 24951700
6-[3-(dimethylamino)propoxy]-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 114524835
6-(3,3-dimethylbutoxy)-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 63094976
2-(3-acetylphenoxy)-N-pentan-3-ylacetamide
CID 60626470

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide?
The IUPAC name of 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide (CID 63095853) is 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide.
What is the SMILES notation for 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide?
The canonical SMILES for 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide is CCC(CC)NC(=O)COc1ccc2c(c1)OCC2NC.
What is the InChIKey of 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide?
The InChIKey is HVAJIOZLUWGTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O3/c1-4-11(5-2)18-16(19)10-20-12-6-7-13-14(17-3)9-21-15(13)8-12/h6-8,11,14,17H,4-5,9-10H2,1-3H3,(H,18,19).
What are the key properties of 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide?
2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide has a molecular weight of 292.38 g/mol, XLogP of 2.02, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(methylamino)-2,3-dihydro-1-benzofuran-6-yl]oxy]-N-pentan-3-ylacetamide is sourced from PubChem (CID 63095853), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).