2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide

C16H18N2O3 — CID 14212835

IUPAC2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1)c1ccc(C)o1
InChIInChI=1S/C16H18N2O3/c1-11-8-9-14(21-11)15(18-12(2)19)16(20)17-10-13-6-4-3-5-7-13/h3-9,15H,10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyFMXRXBXPZSEKCO-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.08
Rot. Bonds5

About 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide

2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide (PubChem CID 14212835) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide.

Molecular Properties

Compound Name2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide
PubChem CID14212835
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide
SMILESCC(=O)NC(C(=O)NCc1ccccc1)c1ccc(C)o1
InChIInChI=1S/C16H18N2O3/c1-11-8-9-14(21-11)15(18-12(2)19)16(20)17-10-13-6-4-3-5-7-13/h3-9,15H,10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyFMXRXBXPZSEKCO-UHFFFAOYSA-N
XLogP2.08
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide?
The IUPAC name of 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide (CID 14212835) is 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide.
What is the SMILES notation for 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide?
The canonical SMILES for 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide is CC(=O)NC(C(=O)NCc1ccccc1)c1ccc(C)o1.
What is the InChIKey of 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide?
The InChIKey is FMXRXBXPZSEKCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-11-8-9-14(21-11)15(18-12(2)19)16(20)17-10-13-6-4-3-5-7-13/h3-9,15H,10H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide?
2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 2.08, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-benzyl-2-(5-methylfuran-2-yl)acetamide is sourced from PubChem (CID 14212835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).