N-(4-phenylphenyl)but-3-en-2-imine

C16H15N — CID 123871939

IUPACN-(4-phenylphenyl)but-3-en-2-imine
SMILESC=C/C(C)=N/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H15N/c1-3-13(2)17-16-11-9-15(10-12-16)14-7-5-4-6-8-14/h3-12H,1H2,2H3/b17-13+
InChIKeyYVMFKRSKESWECA-GHRIWEEISA-N
MW221.30 g/mol
LogP4.63
Rot. Bonds3

About N-(4-phenylphenyl)but-3-en-2-imine

N-(4-phenylphenyl)but-3-en-2-imine (PubChem CID 123871939) has the molecular formula C16H15N and a molecular weight of 221.30 g/mol. Its IUPAC name is N-(4-phenylphenyl)but-3-en-2-imine.

Molecular Properties

Compound NameN-(4-phenylphenyl)but-3-en-2-imine
PubChem CID123871939
Molecular FormulaC16H15N
Molecular Weight221.30 g/mol
Exact Mass221.12
IUPAC NameN-(4-phenylphenyl)but-3-en-2-imine
SMILESC=C/C(C)=N/c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C16H15N/c1-3-13(2)17-16-11-9-15(10-12-16)14-7-5-4-6-8-14/h3-12H,1H2,2H3/b17-13+
InChIKeyYVMFKRSKESWECA-GHRIWEEISA-N
XLogP4.63
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.30
LogP ≤ 54.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,1-dichloro-N-(4-phenylphenyl)methanimine
CID 138974512
N-(4,6-diphenyl-1,3,5-triazin-2-yl)but-3-en-2-imine
CID 123420361
2-N,3-N-bis(4-phenylphenyl)butane-2,3-diimine;dichloronickel
CID 140654060
N'-(4-phenylphenyl)propanimidamide
CID 63178783
1,1'-biphenyl;ethane;prop-1-ene
CID 156726173
(E)-N,4-diphenylbut-3-en-2-imine
CID 5382915
N-phenylprop-2-enimidoyl chloride
CID 15040268
1,4-bis[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]benzene;ethane;1-phenyl-4-[4-[4-[4-[4-[4-[4-[4-[4-(4-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]benzene
CID 162041275
1,4-diphenylbenzene;1-phenyl-4-(4-phenylphenyl)benzene
CID 162098364
buta-1,3-diene;ethane;1-methyl-4-phenylbenzene
CID 143599647
1-(1-fluoroprop-1-en-2-yl)-4-phenylbenzene
CID 134863084
benzene;1,1'-biphenyl;ethenamine
CID 174584589

Frequently Asked Questions

What is the IUPAC name of N-(4-phenylphenyl)but-3-en-2-imine?
The IUPAC name of N-(4-phenylphenyl)but-3-en-2-imine (CID 123871939) is N-(4-phenylphenyl)but-3-en-2-imine.
What is the SMILES notation for N-(4-phenylphenyl)but-3-en-2-imine?
The canonical SMILES for N-(4-phenylphenyl)but-3-en-2-imine is C=C/C(C)=N/c1ccc(-c2ccccc2)cc1.
What is the InChIKey of N-(4-phenylphenyl)but-3-en-2-imine?
The InChIKey is YVMFKRSKESWECA-GHRIWEEISA-N. The full InChI is InChI=1S/C16H15N/c1-3-13(2)17-16-11-9-15(10-12-16)14-7-5-4-6-8-14/h3-12H,1H2,2H3/b17-13+.
What are the key properties of N-(4-phenylphenyl)but-3-en-2-imine?
N-(4-phenylphenyl)but-3-en-2-imine has a molecular weight of 221.30 g/mol, XLogP of 4.63, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-phenylphenyl)but-3-en-2-imine is sourced from PubChem (CID 123871939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).