5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide

C18H15NO3 — CID 790801

IUPAC5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide
SMILESCC(=O)c1cc(C(=O)Nc2ccc3ccccc3c2)c(C)o1
InChIInChI=1S/C18H15NO3/c1-11(20)17-10-16(12(2)22-17)18(21)19-15-8-7-13-5-3-4-6-14(13)9-15/h3-10H,1-2H3,(H,19,21)
InChIKeyOJNZRDCGSWCZPS-UHFFFAOYSA-N
MW293.32 g/mol
LogP4.20
Rot. Bonds3

About 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide

5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide (PubChem CID 790801) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide.

Molecular Properties

Compound Name5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide
PubChem CID790801
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide
SMILESCC(=O)c1cc(C(=O)Nc2ccc3ccccc3c2)c(C)o1
InChIInChI=1S/C18H15NO3/c1-11(20)17-10-16(12(2)22-17)18(21)19-15-8-7-13-5-3-4-6-14(13)9-15/h3-10H,1-2H3,(H,19,21)
InChIKeyOJNZRDCGSWCZPS-UHFFFAOYSA-N
XLogP4.20
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide?
The IUPAC name of 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide (CID 790801) is 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide.
What is the SMILES notation for 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide?
The canonical SMILES for 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide is CC(=O)c1cc(C(=O)Nc2ccc3ccccc3c2)c(C)o1.
What is the InChIKey of 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide?
The InChIKey is OJNZRDCGSWCZPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-11(20)17-10-16(12(2)22-17)18(21)19-15-8-7-13-5-3-4-6-14(13)9-15/h3-10H,1-2H3,(H,19,21).
What are the key properties of 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide?
5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide has a molecular weight of 293.32 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-acetyl-2-methyl-N-naphthalen-2-ylfuran-3-carboxamide is sourced from PubChem (CID 790801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).