N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine

C22H18N2 — CID 76538322

IUPACN-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine
SMILESCC(=NN=C1c2ccccc2-c2ccccc21)c1ccc(C)cc1
InChIInChI=1S/C22H18N2/c1-15-11-13-17(14-12-15)16(2)23-24-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14H,1-2H3
InChIKeySIPSEQXOCUUGOH-UHFFFAOYSA-N
MW310.40 g/mol
LogP5.24
Rot. Bonds2

About N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine

N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine (PubChem CID 76538322) has the molecular formula C22H18N2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine.

Molecular Properties

Compound NameN-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine
PubChem CID76538322
Molecular FormulaC22H18N2
Molecular Weight310.40 g/mol
Exact Mass310.15
IUPAC NameN-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine
SMILESCC(=NN=C1c2ccccc2-c2ccccc21)c1ccc(C)cc1
InChIInChI=1S/C22H18N2/c1-15-11-13-17(14-12-15)16(2)23-24-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14H,1-2H3
InChIKeySIPSEQXOCUUGOH-UHFFFAOYSA-N
XLogP5.24
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.40
LogP ≤ 55.24
H-Bond Donors ≤ 50
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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Related Compounds

N-[2-(4-ethoxyphenyl)ethylideneamino]fluoren-9-imine;N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine
CID 173137487
ethane;(NE)-N-[1-(4-methylphenyl)ethylidene]hydroxylamine
CID 172965019
1-(4-methylphenyl)-N-[(1R)-1-phenylethyl]ethanimine
CID 58667257
N-(fluoren-9-ylideneamino)-4-methylaniline
CID 4130822
(2Z,5S)-2-[(Z)-1-(4-methylphenyl)ethylidenehydrazinylidene]-5-phenyl-1,3-thiazolidin-4-one
CID 137172460
(4-methylphenyl)-[4-[2-(4-methylphenyl)phenyl]phenyl]methanone
CID 175461017
N-ethynyl-1-(4-methylphenyl)ethanimine
CID 142108987
1-[1-(4-methylphenyl)ethylideneamino]-1-phenylethanamine
CID 175636969
2-[(E)-1-(4-phenylphenyl)ethylideneamino]guanidine;hydrochloride
CID 54612215
4-[(Z)-N-[(Z)-1-(4-hydroxyphenyl)ethylideneamino]-C-methylcarbonimidoyl]phenol
CID 135490404
fluoranthene;toluene
CID 173324369
(2Z,5S)-5-methyl-2-[(E)-1-(4-methylphenyl)ethylidenehydrazinylidene]-1,3-thiazolidin-4-one
CID 136822477

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine?
The IUPAC name of N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine (CID 76538322) is N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine.
What is the SMILES notation for N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine?
The canonical SMILES for N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine is CC(=NN=C1c2ccccc2-c2ccccc21)c1ccc(C)cc1.
What is the InChIKey of N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine?
The InChIKey is SIPSEQXOCUUGOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2/c1-15-11-13-17(14-12-15)16(2)23-24-22-20-9-5-3-7-18(20)19-8-4-6-10-21(19)22/h3-14H,1-2H3.
What are the key properties of N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine?
N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine has a molecular weight of 310.40 g/mol, XLogP of 5.24, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-methylphenyl)ethylideneamino]fluoren-9-imine is sourced from PubChem (CID 76538322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).