N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

C15H14N2O4 — CID 3243426

IUPACN-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1ccc(CNC(=O)Cn2c(=O)oc3ccccc32)o1
InChIInChI=1S/C15H14N2O4/c1-10-6-7-11(20-10)8-16-14(18)9-17-12-4-2-3-5-13(12)21-15(17)19/h2-7H,8-9H2,1H3,(H,16,18)
InChIKeyQZGFGJWRHCQUGY-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.81
Rot. Bonds4

About N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide

N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (PubChem CID 3243426) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
PubChem CID3243426
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC NameN-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
SMILESCc1ccc(CNC(=O)Cn2c(=O)oc3ccccc32)o1
InChIInChI=1S/C15H14N2O4/c1-10-6-7-11(20-10)8-16-14(18)9-17-12-4-2-3-5-13(12)21-15(17)19/h2-7H,8-9H2,1H3,(H,16,18)
InChIKeyQZGFGJWRHCQUGY-UHFFFAOYSA-N
XLogP1.81
TPSA77.38 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The IUPAC name of N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide (CID 3243426) is N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide.
What is the SMILES notation for N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The canonical SMILES for N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is Cc1ccc(CNC(=O)Cn2c(=O)oc3ccccc32)o1.
What is the InChIKey of N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
The InChIKey is QZGFGJWRHCQUGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c1-10-6-7-11(20-10)8-16-14(18)9-17-12-4-2-3-5-13(12)21-15(17)19/h2-7H,8-9H2,1H3,(H,16,18).
What are the key properties of N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide?
N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide has a molecular weight of 286.29 g/mol, XLogP of 1.81, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methylfuran-2-yl)methyl]-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide is sourced from PubChem (CID 3243426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).