N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide

C14H17NO4 — CID 94796777

IUPACN-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)C[C@H]1OC(=O)c2ccccc21
InChIInChI=1S/C14H17NO4/c1-9(8-18-2)15-13(16)7-12-10-5-3-4-6-11(10)14(17)19-12/h3-6,9,12H,7-8H2,1-2H3,(H,15,16)/t9-,12-/m1/s1
InChIKeyNQXRCRNFCGHILV-BXKDBHETSA-N
MW263.29 g/mol
LogP1.44
Rot. Bonds5

About N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide

N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide (PubChem CID 94796777) has the molecular formula C14H17NO4 and a molecular weight of 263.29 g/mol. Its IUPAC name is N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide.

Molecular Properties

Compound NameN-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide
PubChem CID94796777
Molecular FormulaC14H17NO4
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC NameN-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide
SMILESCOC[C@@H](C)NC(=O)C[C@H]1OC(=O)c2ccccc21
InChIInChI=1S/C14H17NO4/c1-9(8-18-2)15-13(16)7-12-10-5-3-4-6-11(10)14(17)19-12/h3-6,9,12H,7-8H2,1-2H3,(H,15,16)/t9-,12-/m1/s1
InChIKeyNQXRCRNFCGHILV-BXKDBHETSA-N
XLogP1.44
TPSA64.63 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 ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide?
The IUPAC name of N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide (CID 94796777) is N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide.
What is the SMILES notation for N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide?
The canonical SMILES for N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide is COC[C@@H](C)NC(=O)C[C@H]1OC(=O)c2ccccc21.
What is the InChIKey of N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide?
The InChIKey is NQXRCRNFCGHILV-BXKDBHETSA-N. The full InChI is InChI=1S/C14H17NO4/c1-9(8-18-2)15-13(16)7-12-10-5-3-4-6-11(10)14(17)19-12/h3-6,9,12H,7-8H2,1-2H3,(H,15,16)/t9-,12-/m1/s1.
What are the key properties of N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide?
N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide has a molecular weight of 263.29 g/mol, XLogP of 1.44, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-methoxypropan-2-yl]-2-[(1R)-3-oxo-1H-2-benzofuran-1-yl]acetamide is sourced from PubChem (CID 94796777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).