2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide

C20H22N2O2 — CID 7697671

IUPAC2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCC(C)[C@@H](C)NC(=O)CON=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H22N2O2/c1-13(2)14(3)21-19(23)12-24-22-20-17-10-6-4-8-15(17)16-9-5-7-11-18(16)20/h4-11,13-14H,12H2,1-3H3,(H,21,23)/t14-/m1/s1
InChIKeyPWIQDOVIUZOPHS-CQSZACIVSA-N
MW322.41 g/mol
LogP3.60
Rot. Bonds5

About 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide

2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide (PubChem CID 7697671) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide.

Molecular Properties

Compound Name2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide
PubChem CID7697671
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide
SMILESCC(C)[C@@H](C)NC(=O)CON=C1c2ccccc2-c2ccccc21
InChIInChI=1S/C20H22N2O2/c1-13(2)14(3)21-19(23)12-24-22-20-17-10-6-4-8-15(17)16-9-5-7-11-18(16)20/h4-11,13-14H,12H2,1-3H3,(H,21,23)/t14-/m1/s1
InChIKeyPWIQDOVIUZOPHS-CQSZACIVSA-N
XLogP3.60
TPSA50.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide?
The IUPAC name of 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide (CID 7697671) is 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide.
What is the SMILES notation for 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide?
The canonical SMILES for 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide is CC(C)[C@@H](C)NC(=O)CON=C1c2ccccc2-c2ccccc21.
What is the InChIKey of 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide?
The InChIKey is PWIQDOVIUZOPHS-CQSZACIVSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-13(2)14(3)21-19(23)12-24-22-20-17-10-6-4-8-15(17)16-9-5-7-11-18(16)20/h4-11,13-14H,12H2,1-3H3,(H,21,23)/t14-/m1/s1.
What are the key properties of 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide?
2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide has a molecular weight of 322.41 g/mol, XLogP of 3.60, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(fluoren-9-ylideneamino)oxy-N-[(2R)-3-methylbutan-2-yl]acetamide is sourced from PubChem (CID 7697671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).