N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine

C25H21NO — CID 10641688

IUPACN-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine
SMILESc1ccc(CC(N=C(c2ccccc2)c2ccccc2)c2ccco2)cc1
InChIInChI=1S/C25H21NO/c1-4-11-20(12-5-1)19-23(24-17-10-18-27-24)26-25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18,23H,19H2
InChIKeyDZDIFHHQAWJAGL-UHFFFAOYSA-N
MW351.45 g/mol
LogP6.10
Rot. Bonds6

About N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine

N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine (PubChem CID 10641688) has the molecular formula C25H21NO and a molecular weight of 351.45 g/mol. Its IUPAC name is N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine
PubChem CID10641688
Molecular FormulaC25H21NO
Molecular Weight351.45 g/mol
Exact Mass351.16
IUPAC NameN-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine
SMILESc1ccc(CC(N=C(c2ccccc2)c2ccccc2)c2ccco2)cc1
InChIInChI=1S/C25H21NO/c1-4-11-20(12-5-1)19-23(24-17-10-18-27-24)26-25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18,23H,19H2
InChIKeyDZDIFHHQAWJAGL-UHFFFAOYSA-N
XLogP6.10
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 56.10
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

2-(1-chloro-2-phenylethyl)furan
CID 63016846
3-(benzhydrylideneamino)-4-phenylbutan-2-one
CID 22967228
N-[(1S)-1-(furan-2-yl)-2-phenylethyl]propan-2-amine
CID 125485917
N-(benzhydrylideneamino)-1-(furan-2-yl)ethenamine
CID 2339692
N-[(1R)-1,2-diphenylethyl]-2,2-dimethyl-1-phenylpropan-1-imine
CID 139191179
1,1-diphenyl-N-(4-phenylbutan-2-yl)methan(15N)imine
CID 170780708
1-(furan-2-yl)-N-[(2S)-1-phenylpropan-2-yl]methanimine
CID 10465809
(2S)-2-(benzhydrylideneamino)-3-(4-hydroxyphenyl)propanoic acid
CID 146628240
N-[(1R)-1-(furan-2-yl)-2-phenylethyl]cyclopropanamine
CID 125485850
methyl 2-[[furan-2-yl(phenyl)methylidene]amino]acetate
CID 141348967
2-(furan-2-yl)-4-oxo-4-phenylbutanoic acid
CID 12615241
(benzhydrylideneamino)-triphenylphosphanium
CID 5257506

Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine?
The IUPAC name of N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine (CID 10641688) is N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine.
What is the SMILES notation for N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine?
The canonical SMILES for N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine is c1ccc(CC(N=C(c2ccccc2)c2ccccc2)c2ccco2)cc1.
What is the InChIKey of N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine?
The InChIKey is DZDIFHHQAWJAGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H21NO/c1-4-11-20(12-5-1)19-23(24-17-10-18-27-24)26-25(21-13-6-2-7-14-21)22-15-8-3-9-16-22/h1-18,23H,19H2.
What are the key properties of N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine?
N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine has a molecular weight of 351.45 g/mol, XLogP of 6.10, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)-2-phenylethyl]-1,1-diphenylmethanimine is sourced from PubChem (CID 10641688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).