N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine

C20H15NO — CID 162363450

IUPACN-[(9-phenyldibenzofuran-3-yl)methyl]methanimine
SMILESC=NCc1ccc2c(c1)oc1cccc(-c3ccccc3)c12
InChIInChI=1S/C20H15NO/c1-21-13-14-10-11-17-19(12-14)22-18-9-5-8-16(20(17)18)15-6-3-2-4-7-15/h2-12H,1,13H2
InChIKeyDAKJIWCOQUUCJI-UHFFFAOYSA-N
MW285.35 g/mol
LogP5.45
Rot. Bonds3

About N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine

N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine (PubChem CID 162363450) has the molecular formula C20H15NO and a molecular weight of 285.35 g/mol. Its IUPAC name is N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine.

Molecular Properties

Compound NameN-[(9-phenyldibenzofuran-3-yl)methyl]methanimine
PubChem CID162363450
Molecular FormulaC20H15NO
Molecular Weight285.35 g/mol
Exact Mass285.12
IUPAC NameN-[(9-phenyldibenzofuran-3-yl)methyl]methanimine
SMILESC=NCc1ccc2c(c1)oc1cccc(-c3ccccc3)c12
InChIInChI=1S/C20H15NO/c1-21-13-14-10-11-17-19(12-14)22-18-9-5-8-16(20(17)18)15-6-3-2-4-7-15/h2-12H,1,13H2
InChIKeyDAKJIWCOQUUCJI-UHFFFAOYSA-N
XLogP5.45
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500285.35
LogP ≤ 55.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[(7-phenyldibenzofuran-1-yl)methyl]methanimine
CID 142615378
CID 155656323
CID 155656323
2-phenyl-4-(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164797315
N,9-diphenyldibenzofuran-3-amine
CID 156790002
2,4-bis(4-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164798189
N-benzylmethanimine;9,9-dimethylfluorene;ethane;1-(3-methylphenyl)-8-triphenylen-2-yldibenzofuran
CID 145447202
1-phenyl-7-[10-(3-phenylphenyl)anthracen-9-yl]dibenzofuran
CID 174167645
1-(3-dibenzofuran-1-ylphenyl)dibenzofuran
CID 170213719
2-(4-naphthalen-1-ylphenyl)-4-(9-phenyldibenzofuran-3-yl)-6-[4-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 164797525
1-[3-[3-[3-(3-dibenzofuran-1-ylphenyl)phenyl]phenyl]phenyl]dibenzofuran
CID 90265769
2-(3,5-diphenylphenyl)-4-(3-phenylphenyl)-6-[9-(4-phenylphenyl)dibenzofuran-3-yl]-1,3,5-triazine
CID 164797978
2-phenyl-4-(9-phenyldibenzofuran-3-yl)-6-triphenylen-2-yl-1,3,5-triazine
CID 167377806

Frequently Asked Questions

What is the IUPAC name of N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine?
The IUPAC name of N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine (CID 162363450) is N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine.
What is the SMILES notation for N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine?
The canonical SMILES for N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine is C=NCc1ccc2c(c1)oc1cccc(-c3ccccc3)c12.
What is the InChIKey of N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine?
The InChIKey is DAKJIWCOQUUCJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15NO/c1-21-13-14-10-11-17-19(12-14)22-18-9-5-8-16(20(17)18)15-6-3-2-4-7-15/h2-12H,1,13H2.
What are the key properties of N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine?
N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine has a molecular weight of 285.35 g/mol, XLogP of 5.45, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(9-phenyldibenzofuran-3-yl)methyl]methanimine is sourced from PubChem (CID 162363450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).