N-[2-(fluoren-9-ylideneamino)ethyl]acetamide

C17H16N2O — CID 154187411

IUPACN-[2-(fluoren-9-ylideneamino)ethyl]acetamide
SMILESCC(=O)NCCN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H16N2O/c1-12(20)18-10-11-19-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9H,10-11H2,1H3,(H,18,20)
InChIKeyUQQMQKFQFXRRSO-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.64
Rot. Bonds3

About N-[2-(fluoren-9-ylideneamino)ethyl]acetamide

N-[2-(fluoren-9-ylideneamino)ethyl]acetamide (PubChem CID 154187411) has the molecular formula C17H16N2O and a molecular weight of 264.33 g/mol. Its IUPAC name is N-[2-(fluoren-9-ylideneamino)ethyl]acetamide.

Molecular Properties

Compound NameN-[2-(fluoren-9-ylideneamino)ethyl]acetamide
PubChem CID154187411
Molecular FormulaC17H16N2O
Molecular Weight264.33 g/mol
Exact Mass264.13
IUPAC NameN-[2-(fluoren-9-ylideneamino)ethyl]acetamide
SMILESCC(=O)NCCN=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C17H16N2O/c1-12(20)18-10-11-19-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9H,10-11H2,1H3,(H,18,20)
InChIKeyUQQMQKFQFXRRSO-UHFFFAOYSA-N
XLogP2.64
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-(fluoren-9-ylideneamino)ethyl]acetamide?
The IUPAC name of N-[2-(fluoren-9-ylideneamino)ethyl]acetamide (CID 154187411) is N-[2-(fluoren-9-ylideneamino)ethyl]acetamide.
What is the SMILES notation for N-[2-(fluoren-9-ylideneamino)ethyl]acetamide?
The canonical SMILES for N-[2-(fluoren-9-ylideneamino)ethyl]acetamide is CC(=O)NCCN=C1c2ccccc2-c2ccccc21.
What is the InChIKey of N-[2-(fluoren-9-ylideneamino)ethyl]acetamide?
The InChIKey is UQQMQKFQFXRRSO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N2O/c1-12(20)18-10-11-19-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9H,10-11H2,1H3,(H,18,20).
What are the key properties of N-[2-(fluoren-9-ylideneamino)ethyl]acetamide?
N-[2-(fluoren-9-ylideneamino)ethyl]acetamide has a molecular weight of 264.33 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(fluoren-9-ylideneamino)ethyl]acetamide is sourced from PubChem (CID 154187411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).