2-(2,2-diphenylethenyl)aniline

C20H17N — CID 18963673

IUPAC2-(2,2-diphenylethenyl)aniline
SMILESNc1ccccc1C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17N/c21-20-14-8-7-13-18(20)15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15H,21H2
InChIKeyUTEMLMKASGMVFE-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.86
Rot. Bonds3

About 2-(2,2-diphenylethenyl)aniline

2-(2,2-diphenylethenyl)aniline (PubChem CID 18963673) has the molecular formula C20H17N and a molecular weight of 271.36 g/mol. Its IUPAC name is 2-(2,2-diphenylethenyl)aniline.

Molecular Properties

Compound Name2-(2,2-diphenylethenyl)aniline
PubChem CID18963673
Molecular FormulaC20H17N
Molecular Weight271.36 g/mol
Exact Mass271.14
IUPAC Name2-(2,2-diphenylethenyl)aniline
SMILESNc1ccccc1C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17N/c21-20-14-8-7-13-18(20)15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15H,21H2
InChIKeyUTEMLMKASGMVFE-UHFFFAOYSA-N
XLogP4.86
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-[(Z)-2-methoxy-2-phenylethenyl]aniline
CID 70402722
(Z)-3-(2-aminophenyl)-2-[3-[(Z)-2-(2-aminophenyl)-1-carboxyethenyl]phenyl]prop-2-enoic acid
CID 95564600
CID 173126547
CID 173126547
2-[(E)-2,3,3-trifluoroprop-1-enyl]aniline
CID 171548656
(Z)-3-(2-aminophenyl)-2-(4-fluorophenyl)prop-2-enoic acid
CID 5376034
1,2-bis[(Z)-2-[2-[(Z)-2-(4-benzylphenyl)-2-phenylethenyl]phenyl]ethenyl]benzene
CID 163853364
(2-aminophenyl)methylidenetungsten
CID 20722813
ethane;2-[(E)-prop-1-enyl]aniline
CID 90823299
1,4-bis[(E)-2-[4-(2,2-diphenylethenyl)phenyl]ethenyl]benzene
CID 20678091
CID 172843956
CID 172843956
4-[1-(4-aminophenyl)-4,4-diphenylbuta-1,3-dienyl]aniline
CID 22124141
benzene-1,2-diamine;hydrogen peroxide;hydrochloride
CID 175004407

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diphenylethenyl)aniline?
The IUPAC name of 2-(2,2-diphenylethenyl)aniline (CID 18963673) is 2-(2,2-diphenylethenyl)aniline.
What is the SMILES notation for 2-(2,2-diphenylethenyl)aniline?
The canonical SMILES for 2-(2,2-diphenylethenyl)aniline is Nc1ccccc1C=C(c1ccccc1)c1ccccc1.
What is the InChIKey of 2-(2,2-diphenylethenyl)aniline?
The InChIKey is UTEMLMKASGMVFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N/c21-20-14-8-7-13-18(20)15-19(16-9-3-1-4-10-16)17-11-5-2-6-12-17/h1-15H,21H2.
What are the key properties of 2-(2,2-diphenylethenyl)aniline?
2-(2,2-diphenylethenyl)aniline has a molecular weight of 271.36 g/mol, XLogP of 4.86, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diphenylethenyl)aniline is sourced from PubChem (CID 18963673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).