3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine

C24H20N4 — CID 11291482

IUPAC3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine
SMILESCN(C)CC#Cc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C24H20N4/c1-28(2)15-9-10-18-16-21-24(25-17-18)27-23(20-13-7-4-8-14-20)22(26-21)19-11-5-3-6-12-19/h3-8,11-14,16-17H,15H2,1-2H3
InChIKeyOIHOGFAFGIBHLD-UHFFFAOYSA-N
MW364.45 g/mol
LogP4.27
Rot. Bonds3

About 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine

3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine (PubChem CID 11291482) has the molecular formula C24H20N4 and a molecular weight of 364.45 g/mol. Its IUPAC name is 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine.

Molecular Properties

Compound Name3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine
PubChem CID11291482
Molecular FormulaC24H20N4
Molecular Weight364.45 g/mol
Exact Mass364.17
IUPAC Name3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine
SMILESCN(C)CC#Cc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C24H20N4/c1-28(2)15-9-10-18-16-21-24(25-17-18)27-23(20-13-7-4-8-14-20)22(26-21)19-11-5-3-6-12-19/h3-8,11-14,16-17H,15H2,1-2H3
InChIKeyOIHOGFAFGIBHLD-UHFFFAOYSA-N
XLogP4.27
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine?
The IUPAC name of 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine (CID 11291482) is 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine.
What is the SMILES notation for 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine?
The canonical SMILES for 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine is CN(C)CC#Cc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.
What is the InChIKey of 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine?
The InChIKey is OIHOGFAFGIBHLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20N4/c1-28(2)15-9-10-18-16-21-24(25-17-18)27-23(20-13-7-4-8-14-20)22(26-21)19-11-5-3-6-12-19/h3-8,11-14,16-17H,15H2,1-2H3.
What are the key properties of 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine?
3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine has a molecular weight of 364.45 g/mol, XLogP of 4.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N,N-dimethylprop-2-yn-1-amine is sourced from PubChem (CID 11291482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).