[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate

C17H15NO3 — CID 41198567

IUPAC[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate
SMILESCC(=O)OCC(=O)NC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H15NO3/c1-11(19)21-10-16(20)18-17-14-8-4-2-6-12(14)13-7-3-5-9-15(13)17/h2-9,17H,10H2,1H3,(H,18,20)
InChIKeyNAMLUGSBEAXZFV-UHFFFAOYSA-N
MW281.31 g/mol
LogP2.44
Rot. Bonds3

About [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate

[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate (PubChem CID 41198567) has the molecular formula C17H15NO3 and a molecular weight of 281.31 g/mol. Its IUPAC name is [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate.

Molecular Properties

Compound Name[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate
PubChem CID41198567
Molecular FormulaC17H15NO3
Molecular Weight281.31 g/mol
Exact Mass281.11
IUPAC Name[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate
SMILESCC(=O)OCC(=O)NC1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H15NO3/c1-11(19)21-10-16(20)18-17-14-8-4-2-6-12(14)13-7-3-5-9-15(13)17/h2-9,17H,10H2,1H3,(H,18,20)
InChIKeyNAMLUGSBEAXZFV-UHFFFAOYSA-N
XLogP2.44
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.31
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate?
The IUPAC name of [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate (CID 41198567) is [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate.
What is the SMILES notation for [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate?
The canonical SMILES for [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate is CC(=O)OCC(=O)NC1c2ccccc2-c2ccccc21.
What is the InChIKey of [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate?
The InChIKey is NAMLUGSBEAXZFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO3/c1-11(19)21-10-16(20)18-17-14-8-4-2-6-12(14)13-7-3-5-9-15(13)17/h2-9,17H,10H2,1H3,(H,18,20).
What are the key properties of [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate?
[2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate has a molecular weight of 281.31 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(9H-fluoren-9-ylamino)-2-oxoethyl] acetate is sourced from PubChem (CID 41198567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).