2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide

C13H18N2O3 — CID 62541518

IUPAC2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide
SMILESCOCCNC(C(N)=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C13H18N2O3/c1-17-7-5-15-12(13(14)16)10-2-3-11-9(8-10)4-6-18-11/h2-3,8,12,15H,4-7H2,1H3,(H2,14,16)
InChIKeyPPARLNKRDKPSOC-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.38
Rot. Bonds6

About 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide

2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide (PubChem CID 62541518) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide
PubChem CID62541518
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide
SMILESCOCCNC(C(N)=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C13H18N2O3/c1-17-7-5-15-12(13(14)16)10-2-3-11-9(8-10)4-6-18-11/h2-3,8,12,15H,4-7H2,1H3,(H2,14,16)
InChIKeyPPARLNKRDKPSOC-UHFFFAOYSA-N
XLogP0.38
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-methoxyethylamino)acetamide
CID 62540820
2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)ethanol
CID 55084367
benzyl N-[1-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)-2-oxoethyl]carbamate
CID 20531248
methyl 2-(3-azidopropylamino)-2-(2,3-dihydro-1-benzofuran-5-yl)acetate
CID 66190506
2-(3-bromophenyl)-2-(2-methoxyethylamino)acetamide
CID 62540999
methyl (2R)-2-[[2-(tert-butylamino)-2-oxoethyl]amino]-2-(2,3-dihydro-1-benzofuran-5-yl)acetate
CID 125143182
methyl (2S)-2-(2,3-dihydro-1-benzofuran-5-yl)-2-[(3-methoxyphenyl)methylamino]acetate
CID 124621483
methyl 2-[2,3-dihydro-1-benzofuran-5-yl(hydroxy)methyl]-3-methylbutanoate
CID 62394211
2-(2-methoxyethylamino)-2-(4-methoxy-3-methylphenyl)acetamide
CID 62542227
1-(2,3-dihydro-1-benzofuran-5-yl)-2-methoxyethanol
CID 79567949
2-(2-methoxyethylamino)-2-(3-methoxyphenyl)acetamide
CID 55084492
methyl 3-(2,3-dihydro-1-benzofuran-5-yl)-2,3-dihydroxypropanoate
CID 171864210

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide (CID 62541518) is 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide is COCCNC(C(N)=O)c1ccc2c(c1)CCO2.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide?
The InChIKey is PPARLNKRDKPSOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-17-7-5-15-12(13(14)16)10-2-3-11-9(8-10)4-6-18-11/h2-3,8,12,15H,4-7H2,1H3,(H2,14,16).
What are the key properties of 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide?
2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide has a molecular weight of 250.30 g/mol, XLogP of 0.38, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methoxyethylamino)acetamide is sourced from PubChem (CID 62541518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).