2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide

C23H21N7O — CID 122381522

IUPAC2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide
SMILESO=C(CN(Cc1ccccn1)Cc1ccccn1)Nc1cnc(-c2ccccn2)cn1
InChIInChI=1S/C23H21N7O/c31-23(29-22-14-27-21(13-28-22)20-9-3-6-12-26-20)17-30(15-18-7-1-4-10-24-18)16-19-8-2-5-11-25-19/h1-14H,15-17H2,(H,28,29,31)
InChIKeyGJVIEQBUBCVEBH-UHFFFAOYSA-N
MW411.47 g/mol
LogP2.97
Rot. Bonds8

About 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide

2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide (PubChem CID 122381522) has the molecular formula C23H21N7O and a molecular weight of 411.47 g/mol. Its IUPAC name is 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide.

Molecular Properties

Compound Name2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide
PubChem CID122381522
Molecular FormulaC23H21N7O
Molecular Weight411.47 g/mol
Exact Mass411.18
IUPAC Name2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide
SMILESO=C(CN(Cc1ccccn1)Cc1ccccn1)Nc1cnc(-c2ccccn2)cn1
InChIInChI=1S/C23H21N7O/c31-23(29-22-14-27-21(13-28-22)20-9-3-6-12-26-20)17-30(15-18-7-1-4-10-24-18)16-19-8-2-5-11-25-19/h1-14H,15-17H2,(H,28,29,31)
InChIKeyGJVIEQBUBCVEBH-UHFFFAOYSA-N
XLogP2.97
TPSA96.79 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500411.47
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide with MolForge

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

Launch Full Analysis

Related Compounds

N-(5-pyridin-2-ylpyrazin-2-yl)benzamide
CID 137408648
2-[furan-2-ylmethyl(pyridin-2-ylmethyl)amino]-N-pyrazin-2-ylacetamide
CID 50975744
N-(2-hydroxyphenyl)-2-[(2-hydroxyphenyl)methyl-(pyridin-2-ylmethyl)amino]acetamide
CID 155804068
acetic acid;2-[bis(pyridin-2-ylmethyl)amino]acetic acid
CID 162118901
2-[furan-2-ylmethyl(pyridin-2-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 91833759
2-[2-[[2-oxo-2-(quinolin-8-ylamino)ethyl]-(pyridin-2-ylmethyl)amino]ethyl-(pyridin-2-ylmethyl)amino]-N-quinolin-8-ylacetamide
CID 101498940
copper;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 130339696
2-[bis(pyridin-2-ylmethyl)amino]ethanedithioic acid
CID 140748007
methyl (2R)-2-[[(2R)-2-[[2-[bis(pyridin-2-ylmethyl)amino]acetyl]amino]propanoyl]amino]propanoate
CID 118001065
2-methyl-3-[[2-(methylamino)-2-oxoethyl]-(pyridin-2-ylmethyl)amino]propanoic acid
CID 82330085
2-[bis[2-[carboxymethyl-[2-[2-[carboxymethyl(pyridin-2-ylmethyl)amino]ethylamino]-2-oxoethyl]amino]ethyl]amino]acetic acid
CID 101405847
osmium;pyridine-2-carboxylic acid;1-pyridin-2-yl-N,N-bis(pyridin-2-ylmethyl)methanamine
CID 171575278

Frequently Asked Questions

What is the IUPAC name of 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide?
The IUPAC name of 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide (CID 122381522) is 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide.
What is the SMILES notation for 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide?
The canonical SMILES for 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide is O=C(CN(Cc1ccccn1)Cc1ccccn1)Nc1cnc(-c2ccccn2)cn1.
What is the InChIKey of 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide?
The InChIKey is GJVIEQBUBCVEBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21N7O/c31-23(29-22-14-27-21(13-28-22)20-9-3-6-12-26-20)17-30(15-18-7-1-4-10-24-18)16-19-8-2-5-11-25-19/h1-14H,15-17H2,(H,28,29,31).
What are the key properties of 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide?
2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide has a molecular weight of 411.47 g/mol, XLogP of 2.97, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(pyridin-2-ylmethyl)amino]-N-(5-pyridin-2-ylpyrazin-2-yl)acetamide is sourced from PubChem (CID 122381522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).