4-(2-phenylphenyl)selanylaniline

C18H15NSe — CID 174913171

IUPAC4-(2-phenylphenyl)selanylaniline
SMILESNc1ccc([Se]c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C18H15NSe/c19-15-10-12-16(13-11-15)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,19H2
InChIKeyGDNUGRXFMUFJRV-UHFFFAOYSA-N
MW324.29 g/mol
LogP2.59
Rot. Bonds3

About 4-(2-phenylphenyl)selanylaniline

4-(2-phenylphenyl)selanylaniline (PubChem CID 174913171) has the molecular formula C18H15NSe and a molecular weight of 324.29 g/mol. Its IUPAC name is 4-(2-phenylphenyl)selanylaniline.

Molecular Properties

Compound Name4-(2-phenylphenyl)selanylaniline
PubChem CID174913171
Molecular FormulaC18H15NSe
Molecular Weight324.29 g/mol
Exact Mass325.04
IUPAC Name4-(2-phenylphenyl)selanylaniline
SMILESNc1ccc([Se]c2ccccc2-c2ccccc2)cc1
InChIInChI=1S/C18H15NSe/c19-15-10-12-16(13-11-15)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,19H2
InChIKeyGDNUGRXFMUFJRV-UHFFFAOYSA-N
XLogP2.59
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.29
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[4-(2-phenylphenyl)phenyl]aniline
CID 167431375
aniline;azane;1,1'-biphenyl
CID 172863138
4-[4-(4-aminophenyl)phenyl]-3-(3-phenylphenyl)aniline
CID 150238905
2-phenylaniline;hydrochloride
CID 5284347
CID 159962191
CID 159962191
palladium(2+);2-phenylaniline
CID 175718665
4-[4-(N-[4-(4-aminophenyl)phenyl]-4-phenylanilino)phenyl]aniline
CID 139760283
2,3,6,7-tetraphenyltetraphenylene
CID 134982386
3-[2-(2-phenylphenyl)phenyl]aniline
CID 172502206
4-(2-phenylphenyl)benzene-1,2-diamine
CID 122667618
5-phenylnaphthalen-2-amine
CID 66729016
4-[9-(4-aminophenyl)-14,19-diphenyl-3,10,13,20-tetrathiapentacyclo[15.3.0.02,6.07,11.012,16]icosa-1(17),2(6),4,7(11),8,12(16),14,18-octaen-4-yl]aniline
CID 140932080

Frequently Asked Questions

What is the IUPAC name of 4-(2-phenylphenyl)selanylaniline?
The IUPAC name of 4-(2-phenylphenyl)selanylaniline (CID 174913171) is 4-(2-phenylphenyl)selanylaniline.
What is the SMILES notation for 4-(2-phenylphenyl)selanylaniline?
The canonical SMILES for 4-(2-phenylphenyl)selanylaniline is Nc1ccc([Se]c2ccccc2-c2ccccc2)cc1.
What is the InChIKey of 4-(2-phenylphenyl)selanylaniline?
The InChIKey is GDNUGRXFMUFJRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NSe/c19-15-10-12-16(13-11-15)20-18-9-5-4-8-17(18)14-6-2-1-3-7-14/h1-13H,19H2.
What are the key properties of 4-(2-phenylphenyl)selanylaniline?
4-(2-phenylphenyl)selanylaniline has a molecular weight of 324.29 g/mol, XLogP of 2.59, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-phenylphenyl)selanylaniline is sourced from PubChem (CID 174913171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).