N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine

C24H25N5 — CID 11440499

IUPACN-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCNc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C24H25N5/c1-29(2)15-9-14-25-20-16-21-24(26-17-20)28-23(19-12-7-4-8-13-19)22(27-21)18-10-5-3-6-11-18/h3-8,10-13,16-17,25H,9,14-15H2,1-2H3
InChIKeyWTBIMGZCYXUKEB-UHFFFAOYSA-N
MW383.50 g/mol
LogP4.72
Rot. Bonds7

About N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine

N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine (PubChem CID 11440499) has the molecular formula C24H25N5 and a molecular weight of 383.50 g/mol. Its IUPAC name is N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine
PubChem CID11440499
Molecular FormulaC24H25N5
Molecular Weight383.50 g/mol
Exact Mass383.21
IUPAC NameN-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine
SMILESCN(C)CCCNc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1
InChIInChI=1S/C24H25N5/c1-29(2)15-9-14-25-20-16-21-24(26-17-20)28-23(19-12-7-4-8-13-19)22(27-21)18-10-5-3-6-11-18/h3-8,10-13,16-17,25H,9,14-15H2,1-2H3
InChIKeyWTBIMGZCYXUKEB-UHFFFAOYSA-N
XLogP4.72
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.50
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine?
The IUPAC name of N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine (CID 11440499) is N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine.
What is the SMILES notation for N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine?
The canonical SMILES for N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine is CN(C)CCCNc1cnc2nc(-c3ccccc3)c(-c3ccccc3)nc2c1.
What is the InChIKey of N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine?
The InChIKey is WTBIMGZCYXUKEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N5/c1-29(2)15-9-14-25-20-16-21-24(26-17-20)28-23(19-12-7-4-8-13-19)22(27-21)18-10-5-3-6-11-18/h3-8,10-13,16-17,25H,9,14-15H2,1-2H3.
What are the key properties of N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine?
N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine has a molecular weight of 383.50 g/mol, XLogP of 4.72, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-diphenylpyrido[2,3-b]pyrazin-7-yl)-N',N'-dimethylpropane-1,3-diamine is sourced from PubChem (CID 11440499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).