1,2,2-triphenylethenamine

C20H17N — CID 23327732

IUPAC1,2,2-triphenylethenamine
SMILESNC(=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17N/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15H,21H2
InChIKeyKEQFAIKLHXZWIW-UHFFFAOYSA-N
MW271.36 g/mol
LogP4.56
Rot. Bonds3

About 1,2,2-triphenylethenamine

1,2,2-triphenylethenamine (PubChem CID 23327732) has the molecular formula C20H17N and a molecular weight of 271.36 g/mol. Its IUPAC name is 1,2,2-triphenylethenamine.

Molecular Properties

Compound Name1,2,2-triphenylethenamine
PubChem CID23327732
Molecular FormulaC20H17N
Molecular Weight271.36 g/mol
Exact Mass271.14
IUPAC Name1,2,2-triphenylethenamine
SMILESNC(=C(c1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C20H17N/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15H,21H2
InChIKeyKEQFAIKLHXZWIW-UHFFFAOYSA-N
XLogP4.56
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 ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2,2-triphenylethenamine?
The IUPAC name of 1,2,2-triphenylethenamine (CID 23327732) is 1,2,2-triphenylethenamine.
What is the SMILES notation for 1,2,2-triphenylethenamine?
The canonical SMILES for 1,2,2-triphenylethenamine is NC(=C(c1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of 1,2,2-triphenylethenamine?
The InChIKey is KEQFAIKLHXZWIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N/c21-20(18-14-8-3-9-15-18)19(16-10-4-1-5-11-16)17-12-6-2-7-13-17/h1-15H,21H2.
What are the key properties of 1,2,2-triphenylethenamine?
1,2,2-triphenylethenamine has a molecular weight of 271.36 g/mol, XLogP of 4.56, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2-triphenylethenamine is sourced from PubChem (CID 23327732), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).