N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide

C14H17NO4 — CID 110488782

IUPACN-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide
SMILESCOc1ccc2occ(CC(=O)N(C)CCO)c2c1
InChIInChI=1S/C14H17NO4/c1-15(5-6-16)14(17)7-10-9-19-13-4-3-11(18-2)8-12(10)13/h3-4,8-9,16H,5-7H2,1-2H3
InChIKeyGIMKMODPUQKERO-UHFFFAOYSA-N
MW263.29 g/mol
LogP1.43
Rot. Bonds5

About N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide

N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide (PubChem CID 110488782) has the molecular formula C14H17NO4 and a molecular weight of 263.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide
PubChem CID110488782
Molecular FormulaC14H17NO4
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC NameN-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide
SMILESCOc1ccc2occ(CC(=O)N(C)CCO)c2c1
InChIInChI=1S/C14H17NO4/c1-15(5-6-16)14(17)7-10-9-19-13-4-3-11(18-2)8-12(10)13/h3-4,8-9,16H,5-7H2,1-2H3
InChIKeyGIMKMODPUQKERO-UHFFFAOYSA-N
XLogP1.43
TPSA62.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(5-fluoro-1-benzofuran-3-yl)-N-(2-hydroxyethyl)-N-methylacetamide
CID 110488687
N-(1-hydroxy-2-methylpropan-2-yl)-2-(5-methoxy-1-benzofuran-3-yl)acetamide
CID 110488794
2-(6-methoxy-1-benzofuran-3-yl)-N-methyl-N-[2-(3-methylphenoxy)ethyl]acetamide
CID 26980149
3-(5-methoxy-1-benzofuran-3-yl)propanoate
CID 6921490
2-(5-methoxy-1-benzofuran-3-yl)-1-pyrrolidin-1-ylethanone
CID 110488784
2-(5-methoxy-1-benzofuran-3-yl)acetaldehyde
CID 117195628
N-(2,5-dimethylpyrrol-1-yl)-2-(5-methoxy-1-benzofuran-3-yl)acetamide
CID 167531222
2-(5-methoxy-1-benzofuran-3-yl)-N-naphthalen-2-ylacetamide
CID 18860246
2-(6-methoxy-1-benzofuran-3-yl)-N-methyl-N-(pyridin-2-ylmethyl)acetamide
CID 55980249
2-(5-methoxy-1-benzofuran-3-yl)-1-[4-(4-methoxyphenyl)piperazin-1-yl]ethanone
CID 18860283
2-benzo[e][1]benzofuran-1-yl-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 31240268
N-[[(3R)-2,3-dihydro-1,4-benzodioxin-3-yl]methyl]-2-(6-methoxy-1-benzofuran-3-yl)-N-methylacetamide
CID 2532585

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide?
The IUPAC name of N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide (CID 110488782) is N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide.
What is the SMILES notation for N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide?
The canonical SMILES for N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide is COc1ccc2occ(CC(=O)N(C)CCO)c2c1.
What is the InChIKey of N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide?
The InChIKey is GIMKMODPUQKERO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO4/c1-15(5-6-16)14(17)7-10-9-19-13-4-3-11(18-2)8-12(10)13/h3-4,8-9,16H,5-7H2,1-2H3.
What are the key properties of N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide?
N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide has a molecular weight of 263.29 g/mol, XLogP of 1.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-2-(5-methoxy-1-benzofuran-3-yl)-N-methylacetamide is sourced from PubChem (CID 110488782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).