N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide

C14H17NO3 — CID 129354527

IUPACN-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)Cc1cc2ccccc2o1
InChIInChI=1S/C14H17NO3/c1-10(15-14(16)9-17-2)7-12-8-11-5-3-4-6-13(11)18-12/h3-6,8,10H,7,9H2,1-2H3,(H,15,16)/t10-/m1/s1
InChIKeyALWZLKQVTDNSDA-SNVBAGLBSA-N
MW247.29 g/mol
LogP2.13
Rot. Bonds5

About N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide

N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide (PubChem CID 129354527) has the molecular formula C14H17NO3 and a molecular weight of 247.29 g/mol. Its IUPAC name is N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide
PubChem CID129354527
Molecular FormulaC14H17NO3
Molecular Weight247.29 g/mol
Exact Mass247.12
IUPAC NameN-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)Cc1cc2ccccc2o1
InChIInChI=1S/C14H17NO3/c1-10(15-14(16)9-17-2)7-12-8-11-5-3-4-6-13(11)18-12/h3-6,8,10H,7,9H2,1-2H3,(H,15,16)/t10-/m1/s1
InChIKeyALWZLKQVTDNSDA-SNVBAGLBSA-N
XLogP2.13
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.29
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide?
The IUPAC name of N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide (CID 129354527) is N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide.
What is the SMILES notation for N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide?
The canonical SMILES for N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide is COCC(=O)N[C@H](C)Cc1cc2ccccc2o1.
What is the InChIKey of N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide?
The InChIKey is ALWZLKQVTDNSDA-SNVBAGLBSA-N. The full InChI is InChI=1S/C14H17NO3/c1-10(15-14(16)9-17-2)7-12-8-11-5-3-4-6-13(11)18-12/h3-6,8,10H,7,9H2,1-2H3,(H,15,16)/t10-/m1/s1.
What are the key properties of N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide?
N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide has a molecular weight of 247.29 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-(1-benzofuran-2-yl)propan-2-yl]-2-methoxyacetamide is sourced from PubChem (CID 129354527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).