2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide

C21H15NO3 — CID 69107536

IUPAC2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide
SMILESCOc1ccccc1-c1ccc2c(c1C(N)=O)C(=O)c1ccccc1-2
InChIInChI=1S/C21H15NO3/c1-25-17-9-5-4-7-13(17)15-11-10-14-12-6-2-3-8-16(12)20(23)18(14)19(15)21(22)24/h2-11H,1H3,(H2,22,24)
InChIKeyKITHPRRROSPNGZ-UHFFFAOYSA-N
MW329.36 g/mol
LogP3.67
Rot. Bonds3

About 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide

2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide (PubChem CID 69107536) has the molecular formula C21H15NO3 and a molecular weight of 329.36 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide
PubChem CID69107536
Molecular FormulaC21H15NO3
Molecular Weight329.36 g/mol
Exact Mass329.11
IUPAC Name2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide
SMILESCOc1ccccc1-c1ccc2c(c1C(N)=O)C(=O)c1ccccc1-2
InChIInChI=1S/C21H15NO3/c1-25-17-9-5-4-7-13(17)15-11-10-14-12-6-2-3-8-16(12)20(23)18(14)19(15)21(22)24/h2-11H,1H3,(H2,22,24)
InChIKeyKITHPRRROSPNGZ-UHFFFAOYSA-N
XLogP3.67
TPSA69.39 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.36
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide?
The IUPAC name of 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide (CID 69107536) is 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide?
The canonical SMILES for 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide is COc1ccccc1-c1ccc2c(c1C(N)=O)C(=O)c1ccccc1-2.
What is the InChIKey of 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide?
The InChIKey is KITHPRRROSPNGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H15NO3/c1-25-17-9-5-4-7-13(17)15-11-10-14-12-6-2-3-8-16(12)20(23)18(14)19(15)21(22)24/h2-11H,1H3,(H2,22,24).
What are the key properties of 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide?
2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide has a molecular weight of 329.36 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-9-oxofluorene-1-carboxamide is sourced from PubChem (CID 69107536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).