2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide

C18H18N2O2 — CID 41194976

IUPAC2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESCc1ccc2c(CC(=O)N[C@H](C)c3ccccn3)coc2c1
InChIInChI=1S/C18H18N2O2/c1-12-6-7-15-14(11-22-17(15)9-12)10-18(21)20-13(2)16-5-3-4-8-19-16/h3-9,11,13H,10H2,1-2H3,(H,20,21)/t13-/m1/s1
InChIKeyDWNCOZZENKRNDK-CYBMUJFWSA-N
MW294.35 g/mol
LogP3.56
Rot. Bonds4

About 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide

2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide (PubChem CID 41194976) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide.

Molecular Properties

Compound Name2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
PubChem CID41194976
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
SMILESCc1ccc2c(CC(=O)N[C@H](C)c3ccccn3)coc2c1
InChIInChI=1S/C18H18N2O2/c1-12-6-7-15-14(11-22-17(15)9-12)10-18(21)20-13(2)16-5-3-4-8-19-16/h3-9,11,13H,10H2,1-2H3,(H,20,21)/t13-/m1/s1
InChIKeyDWNCOZZENKRNDK-CYBMUJFWSA-N
XLogP3.56
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(5,6-dimethyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 51968597
2-benzo[e][1]benzofuran-1-yl-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 8700530
2-(4-methylphenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337547
2-(6-methyl-1-benzofuran-3-yl)-N-(4-phenylbutan-2-yl)acetamide
CID 4877348
2-(2-hydroxyphenyl)-N-(1-pyridin-2-ylethyl)acetamide
CID 78990806
3-(2,4-dimethylphenyl)-N-(1-pyridin-2-ylethyl)propanamide
CID 24645511
2-(2-chlorophenyl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 25337037
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331
2-(6-methyl-1-benzofuran-3-yl)-N-(5-phenyl-2-pyridinyl)acetamide
CID 55978691
2-(3,4-dichlorophenyl)-N-(1-pyridin-2-ylethyl)acetamide
CID 47097455
2-bromo-N-[(1S)-1-pyridin-2-ylethyl]acetamide
CID 81401514
N'-[2-(2-ethoxyphenoxy)acetyl]-2-(6-methyl-1-benzofuran-3-yl)acetohydrazide
CID 18159262

Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide (CID 41194976) is 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide.
What is the SMILES notation for 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The canonical SMILES for 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide is Cc1ccc2c(CC(=O)N[C@H](C)c3ccccn3)coc2c1.
What is the InChIKey of 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
The InChIKey is DWNCOZZENKRNDK-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-6-7-15-14(11-22-17(15)9-12)10-18(21)20-13(2)16-5-3-4-8-19-16/h3-9,11,13H,10H2,1-2H3,(H,20,21)/t13-/m1/s1.
What are the key properties of 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide?
2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide has a molecular weight of 294.35 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methyl-1-benzofuran-3-yl)-N-[(1R)-1-pyridin-2-ylethyl]acetamide is sourced from PubChem (CID 41194976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).