2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide

C17H16N2O2 — CID 43738402

IUPAC2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NCc1cc2ccccc2o1
InChIInChI=1S/C17H16N2O2/c18-17(20)10-12-5-1-3-7-15(12)19-11-14-9-13-6-2-4-8-16(13)21-14/h1-9,19H,10-11H2,(H2,18,20)
InChIKeyIPYDHXPCINYOCX-UHFFFAOYSA-N
MW280.33 g/mol
LogP3.07
Rot. Bonds5

About 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide

2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide (PubChem CID 43738402) has the molecular formula C17H16N2O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide.

Molecular Properties

Compound Name2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide
PubChem CID43738402
Molecular FormulaC17H16N2O2
Molecular Weight280.33 g/mol
Exact Mass280.12
IUPAC Name2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide
SMILESNC(=O)Cc1ccccc1NCc1cc2ccccc2o1
InChIInChI=1S/C17H16N2O2/c18-17(20)10-12-5-1-3-7-15(12)19-11-14-9-13-6-2-4-8-16(13)21-14/h1-9,19H,10-11H2,(H2,18,20)
InChIKeyIPYDHXPCINYOCX-UHFFFAOYSA-N
XLogP3.07
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[[2-(2-amino-2-oxoethyl)anilino]methyl]furan-3-carboxylic acid
CID 104608536
2-[2-(1-benzofuran-3-ylmethylamino)phenyl]acetamide
CID 80700430
4-(1-benzofuran-2-ylmethylamino)-3-methylbenzoic acid
CID 43736002
N-(1-benzofuran-2-ylmethyl)-1-benzofuran-2-carboxamide
CID 86994462
1-(1-benzofuran-2-ylmethyl)-3-[[2-(hydroxymethyl)phenyl]methyl]urea
CID 110924364
2-(1-benzofuran-2-ylmethylamino)propanamide
CID 43402391
2-[2-[(2-chlorophenyl)methylamino]phenyl]acetamide
CID 43738427
2-[2-[(2,4,5-trimethylphenyl)methylamino]phenyl]acetamide
CID 43789637
N-(1-benzofuran-2-ylmethyl)quinolin-8-amine
CID 30056544
2-[2-[(2,3-dihydroxyphenyl)methylamino]phenyl]acetamide
CID 61317267
N-(1-benzofuran-2-ylmethyl)-2,4-dibromoaniline
CID 43683009
3-(1-benzofuran-2-ylmethylamino)-2-nitrobenzenesulfonamide
CID 75522217

Frequently Asked Questions

What is the IUPAC name of 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide?
The IUPAC name of 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide (CID 43738402) is 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide.
What is the SMILES notation for 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide?
The canonical SMILES for 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide is NC(=O)Cc1ccccc1NCc1cc2ccccc2o1.
What is the InChIKey of 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide?
The InChIKey is IPYDHXPCINYOCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O2/c18-17(20)10-12-5-1-3-7-15(12)19-11-14-9-13-6-2-4-8-16(13)21-14/h1-9,19H,10-11H2,(H2,18,20).
What are the key properties of 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide?
2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide has a molecular weight of 280.33 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(1-benzofuran-2-ylmethylamino)phenyl]acetamide is sourced from PubChem (CID 43738402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).