N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide

C17H15NO3 — CID 2141992

IUPACN-(2-methoxyethyl)-9-oxofluorene-2-carboxamide
SMILESCOCCNC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C17H15NO3/c1-21-9-8-18-17(20)11-6-7-13-12-4-2-3-5-14(12)16(19)15(13)10-11/h2-7,10H,8-9H2,1H3,(H,18,20)
InChIKeyYYLJOMJLFSWTNJ-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.27
Rot. Bonds4

About N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide

N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide (PubChem CID 2141992) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-9-oxofluorene-2-carboxamide
PubChem CID2141992
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC NameN-(2-methoxyethyl)-9-oxofluorene-2-carboxamide
SMILESCOCCNC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2
InChIInChI=1S/C17H15NO3/c1-21-9-8-18-17(20)11-6-7-13-12-4-2-3-5-14(12)16(19)15(13)10-11/h2-7,10H,8-9H2,1H3,(H,18,20)
InChIKeyYYLJOMJLFSWTNJ-UHFFFAOYSA-N
XLogP2.27
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide?
The IUPAC name of N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide (CID 2141992) is N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide.
What is the SMILES notation for N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide?
The canonical SMILES for N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide is COCCNC(=O)c1ccc2c(c1)C(=O)c1ccccc1-2.
What is the InChIKey of N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide?
The InChIKey is YYLJOMJLFSWTNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-21-9-8-18-17(20)11-6-7-13-12-4-2-3-5-14(12)16(19)15(13)10-11/h2-7,10H,8-9H2,1H3,(H,18,20).
What are the key properties of N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide?
N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide has a molecular weight of 281.31 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-9-oxofluorene-2-carboxamide is sourced from PubChem (CID 2141992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).