2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide

C12H16N2O2 — CID 43754741

IUPAC2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide
SMILESCC(NCC(N)=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C12H16N2O2/c1-8(14-7-12(13)15)9-2-3-11-10(6-9)4-5-16-11/h2-3,6,8,14H,4-5,7H2,1H3,(H2,13,15)
InChIKeyRIVZTXPPFXVDQN-UHFFFAOYSA-N
MW220.27 g/mol
LogP0.76
Rot. Bonds4

About 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide

2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide (PubChem CID 43754741) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide.

Molecular Properties

Compound Name2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide
PubChem CID43754741
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide
SMILESCC(NCC(N)=O)c1ccc2c(c1)CCO2
InChIInChI=1S/C12H16N2O2/c1-8(14-7-12(13)15)9-2-3-11-10(6-9)4-5-16-11/h2-3,6,8,14H,4-5,7H2,1H3,(H2,13,15)
InChIKeyRIVZTXPPFXVDQN-UHFFFAOYSA-N
XLogP0.76
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]-N-(2-methylpropyl)acetamide
CID 115900436
2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]propanamide
CID 43777118
ethyl 4-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]butanoate
CID 64579498
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-ethylbutan-1-amine
CID 115718022
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-2-methylsulfinylpropan-1-amine
CID 115896124
2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]-N,N-dimethylpropanamide
CID 43778171
2-[2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]ethoxy]ethanol
CID 43771488
N-[2-[[(1S)-1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]amino]-2-oxoethyl]prop-2-enamide
CID 166411557
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-4-methylpentan-2-amine
CID 43775759
ethyl 2-acetyloxy-2-(2,3-dihydro-1-benzofuran-5-yl)acetate
CID 54458812
N-[1-(2,3-dihydro-1-benzofuran-5-yl)ethyl]-3-propan-2-yloxypropan-1-amine
CID 43771401
2-[4-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]pyrazol-1-yl]acetamide
CID 43783595

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide?
The IUPAC name of 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide (CID 43754741) is 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide.
What is the SMILES notation for 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide?
The canonical SMILES for 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide is CC(NCC(N)=O)c1ccc2c(c1)CCO2.
What is the InChIKey of 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide?
The InChIKey is RIVZTXPPFXVDQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8(14-7-12(13)15)9-2-3-11-10(6-9)4-5-16-11/h2-3,6,8,14H,4-5,7H2,1H3,(H2,13,15).
What are the key properties of 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide?
2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide has a molecular weight of 220.27 g/mol, XLogP of 0.76, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,3-dihydro-1-benzofuran-5-yl)ethylamino]acetamide is sourced from PubChem (CID 43754741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).