2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide

C14H13N3O2 — CID 61393726

IUPAC2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide
SMILESCc1ccc2c(CC(=O)Nc3ccn[nH]3)coc2c1
InChIInChI=1S/C14H13N3O2/c1-9-2-3-11-10(8-19-12(11)6-9)7-14(18)16-13-4-5-15-17-13/h2-6,8H,7H2,1H3,(H2,15,16,17,18)
InChIKeyZNMIIYGJPXXSRP-UHFFFAOYSA-N
MW255.28 g/mol
LogP2.65
Rot. Bonds3

About 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide

2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide (PubChem CID 61393726) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide
PubChem CID61393726
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC Name2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide
SMILESCc1ccc2c(CC(=O)Nc3ccn[nH]3)coc2c1
InChIInChI=1S/C14H13N3O2/c1-9-2-3-11-10(8-19-12(11)6-9)7-14(18)16-13-4-5-15-17-13/h2-6,8H,7H2,1H3,(H2,15,16,17,18)
InChIKeyZNMIIYGJPXXSRP-UHFFFAOYSA-N
XLogP2.65
TPSA70.92 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide?
The IUPAC name of 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide (CID 61393726) is 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide.
What is the SMILES notation for 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide?
The canonical SMILES for 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide is Cc1ccc2c(CC(=O)Nc3ccn[nH]3)coc2c1.
What is the InChIKey of 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide?
The InChIKey is ZNMIIYGJPXXSRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c1-9-2-3-11-10(8-19-12(11)6-9)7-14(18)16-13-4-5-15-17-13/h2-6,8H,7H2,1H3,(H2,15,16,17,18).
What are the key properties of 2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide?
2-(6-methyl-1-benzofuran-3-yl)-N-(1H-pyrazol-5-yl)acetamide has a molecular weight of 255.28 g/mol, XLogP of 2.65, 3 rotatable bonds, 2 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-(1H-pyrazol-5-yl)acetamide is sourced from PubChem (CID 61393726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).