N-prop-2-enoxyfluoren-2-imine

C16H13NO — CID 142232893

IUPACN-prop-2-enoxyfluoren-2-imine
SMILESC=CCON=C1C=CC2=c3ccccc3=CC2=C1
InChIInChI=1S/C16H13NO/c1-2-9-18-17-14-7-8-16-13(11-14)10-12-5-3-4-6-15(12)16/h2-8,10-11H,1,9H2
InChIKeyJAJCNYLYINFUOD-UHFFFAOYSA-N
MW235.29 g/mol
LogP1.69
Rot. Bonds3

About N-prop-2-enoxyfluoren-2-imine

N-prop-2-enoxyfluoren-2-imine (PubChem CID 142232893) has the molecular formula C16H13NO and a molecular weight of 235.29 g/mol. Its IUPAC name is N-prop-2-enoxyfluoren-2-imine.

Molecular Properties

Compound NameN-prop-2-enoxyfluoren-2-imine
PubChem CID142232893
Molecular FormulaC16H13NO
Molecular Weight235.29 g/mol
Exact Mass235.10
IUPAC NameN-prop-2-enoxyfluoren-2-imine
SMILESC=CCON=C1C=CC2=c3ccccc3=CC2=C1
InChIInChI=1S/C16H13NO/c1-2-9-18-17-14-7-8-16-13(11-14)10-12-5-3-4-6-15(12)16/h2-8,10-11H,1,9H2
InChIKeyJAJCNYLYINFUOD-UHFFFAOYSA-N
XLogP1.69
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 51.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 N-prop-2-enoxyfluoren-2-imine?
The IUPAC name of N-prop-2-enoxyfluoren-2-imine (CID 142232893) is N-prop-2-enoxyfluoren-2-imine.
What is the SMILES notation for N-prop-2-enoxyfluoren-2-imine?
The canonical SMILES for N-prop-2-enoxyfluoren-2-imine is C=CCON=C1C=CC2=c3ccccc3=CC2=C1.
What is the InChIKey of N-prop-2-enoxyfluoren-2-imine?
The InChIKey is JAJCNYLYINFUOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13NO/c1-2-9-18-17-14-7-8-16-13(11-14)10-12-5-3-4-6-15(12)16/h2-8,10-11H,1,9H2.
What are the key properties of N-prop-2-enoxyfluoren-2-imine?
N-prop-2-enoxyfluoren-2-imine has a molecular weight of 235.29 g/mol, XLogP of 1.69, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-prop-2-enoxyfluoren-2-imine is sourced from PubChem (CID 142232893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).