N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine

C20H14F2N2 — CID 177452207

IUPACN-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine
SMILESFc1cccc(/C=N/Nc2ccc3c(c2)Cc2ccccc2-3)c1F
InChIInChI=1S/C20H14F2N2/c21-19-7-3-5-14(20(19)22)12-23-24-16-8-9-18-15(11-16)10-13-4-1-2-6-17(13)18/h1-9,11-12,24H,10H2/b23-12+
InChIKeyJMEWOJMQENBKBB-FSJBWODESA-N
MW320.34 g/mol
LogP4.98
Rot. Bonds3

About N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine

N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine (PubChem CID 177452207) has the molecular formula C20H14F2N2 and a molecular weight of 320.34 g/mol. Its IUPAC name is N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine.

Molecular Properties

Compound NameN-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine
PubChem CID177452207
Molecular FormulaC20H14F2N2
Molecular Weight320.34 g/mol
Exact Mass320.11
IUPAC NameN-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine
SMILESFc1cccc(/C=N/Nc2ccc3c(c2)Cc2ccccc2-3)c1F
InChIInChI=1S/C20H14F2N2/c21-19-7-3-5-14(20(19)22)12-23-24-16-8-9-18-15(11-16)10-13-4-1-2-6-17(13)18/h1-9,11-12,24H,10H2/b23-12+
InChIKeyJMEWOJMQENBKBB-FSJBWODESA-N
XLogP4.98
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.34
LogP ≤ 54.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine?
The IUPAC name of N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine (CID 177452207) is N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine.
What is the SMILES notation for N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine?
The canonical SMILES for N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine is Fc1cccc(/C=N/Nc2ccc3c(c2)Cc2ccccc2-3)c1F.
What is the InChIKey of N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine?
The InChIKey is JMEWOJMQENBKBB-FSJBWODESA-N. The full InChI is InChI=1S/C20H14F2N2/c21-19-7-3-5-14(20(19)22)12-23-24-16-8-9-18-15(11-16)10-13-4-1-2-6-17(13)18/h1-9,11-12,24H,10H2/b23-12+.
What are the key properties of N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine?
N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine has a molecular weight of 320.34 g/mol, XLogP of 4.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(E)-(2,3-difluorophenyl)methylideneamino]-9H-fluoren-2-amine is sourced from PubChem (CID 177452207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).