(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine

C13H10N2O — CID 5380841

IUPAC(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine
SMILESNc1cccc2c1-c1ccccc1/C2=N\O
InChIInChI=1S/C13H10N2O/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15-16/h1-7,16H,14H2/b15-13+
InChIKeyXRZSNPWPEMEVHA-FYWRMAATSA-N
MW210.24 g/mol
LogP2.48
Rot. Bonds

About (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine

(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine (PubChem CID 5380841) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine.

Molecular Properties

Compound Name(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine
PubChem CID5380841
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine
SMILESNc1cccc2c1-c1ccccc1/C2=N\O
InChIInChI=1S/C13H10N2O/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15-16/h1-7,16H,14H2/b15-13+
InChIKeyXRZSNPWPEMEVHA-FYWRMAATSA-N
XLogP2.48
TPSA58.61 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'oxime_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 (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine?
The IUPAC name of (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine (CID 5380841) is (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine.
What is the SMILES notation for (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine?
The canonical SMILES for (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine is Nc1cccc2c1-c1ccccc1/C2=N\O.
What is the InChIKey of (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine?
The InChIKey is XRZSNPWPEMEVHA-FYWRMAATSA-N. The full InChI is InChI=1S/C13H10N2O/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13(10)15-16/h1-7,16H,14H2/b15-13+.
What are the key properties of (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine?
(NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine has a molecular weight of 210.24 g/mol, XLogP of 2.48, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (NE)-N-(4-aminofluoren-9-ylidene)hydroxylamine is sourced from PubChem (CID 5380841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).