2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide

C14H16N2O3 — CID 1133386

IUPAC2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNCc2ccco2)c1
InChIInChI=1S/C14H16N2O3/c1-18-12-5-2-4-11(8-12)16-14(17)10-15-9-13-6-3-7-19-13/h2-8,15H,9-10H2,1H3,(H,16,17)
InChIKeyWWJZFBCORQGLSJ-UHFFFAOYSA-N
MW260.29 g/mol
LogP2.02
Rot. Bonds6

About 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide

2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide (PubChem CID 1133386) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide
PubChem CID1133386
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(NC(=O)CNCc2ccco2)c1
InChIInChI=1S/C14H16N2O3/c1-18-12-5-2-4-11(8-12)16-14(17)10-15-9-13-6-3-7-19-13/h2-8,15H,9-10H2,1H3,(H,16,17)
InChIKeyWWJZFBCORQGLSJ-UHFFFAOYSA-N
XLogP2.02
TPSA63.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide?
The IUPAC name of 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide (CID 1133386) is 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide?
The canonical SMILES for 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide is COc1cccc(NC(=O)CNCc2ccco2)c1.
What is the InChIKey of 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide?
The InChIKey is WWJZFBCORQGLSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-18-12-5-2-4-11(8-12)16-14(17)10-15-9-13-6-3-7-19-13/h2-8,15H,9-10H2,1H3,(H,16,17).
What are the key properties of 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide?
2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide has a molecular weight of 260.29 g/mol, XLogP of 2.02, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-2-ylmethylamino)-N-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 1133386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).