N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine

C31H30N2 — CID 59758626

IUPACN,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine
SMILESCN(C=C(c1ccccc1)c1ccccc1)CN(C)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H30N2/c1-32(23-30(26-15-7-3-8-16-26)27-17-9-4-10-18-27)25-33(2)24-31(28-19-11-5-12-20-28)29-21-13-6-14-22-29/h3-24H,25H2,1-2H3
InChIKeyGTGSXPQVFCQVQW-UHFFFAOYSA-N
MW430.60 g/mol
LogP6.99
Rot. Bonds8

About N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine

N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine (PubChem CID 59758626) has the molecular formula C31H30N2 and a molecular weight of 430.60 g/mol. Its IUPAC name is N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine.

Molecular Properties

Compound NameN,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine
PubChem CID59758626
Molecular FormulaC31H30N2
Molecular Weight430.60 g/mol
Exact Mass430.24
IUPAC NameN,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine
SMILESCN(C=C(c1ccccc1)c1ccccc1)CN(C)C=C(c1ccccc1)c1ccccc1
InChIInChI=1S/C31H30N2/c1-32(23-30(26-15-7-3-8-16-26)27-17-9-4-10-18-27)25-33(2)24-31(28-19-11-5-12-20-28)29-21-13-6-14-22-29/h3-24H,25H2,1-2H3
InChIKeyGTGSXPQVFCQVQW-UHFFFAOYSA-N
XLogP6.99
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500430.60
LogP ≤ 56.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hzone_phenone(7)', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine?
The IUPAC name of N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine (CID 59758626) is N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine.
What is the SMILES notation for N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine?
The canonical SMILES for N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine is CN(C=C(c1ccccc1)c1ccccc1)CN(C)C=C(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine?
The InChIKey is GTGSXPQVFCQVQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H30N2/c1-32(23-30(26-15-7-3-8-16-26)27-17-9-4-10-18-27)25-33(2)24-31(28-19-11-5-12-20-28)29-21-13-6-14-22-29/h3-24H,25H2,1-2H3.
What are the key properties of N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine?
N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine has a molecular weight of 430.60 g/mol, XLogP of 6.99, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,2-diphenylethenyl)-N,N'-dimethylmethanediamine is sourced from PubChem (CID 59758626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).