N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide

C21H16N6O — CID 58447927

IUPACN-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide
SMILESO=C(Cc1ccc(-c2ccncc2)nc1)Nc1ccc(-c2cccnn2)cn1
InChIInChI=1S/C21H16N6O/c28-21(12-15-3-5-18(23-13-15)16-7-10-22-11-8-16)26-20-6-4-17(14-24-20)19-2-1-9-25-27-19/h1-11,13-14H,12H2,(H,24,26,28)
InChIKeySRPYYTPEVBKMBF-UHFFFAOYSA-N
MW368.40 g/mol
LogP3.18
Rot. Bonds5

About N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide

N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide (PubChem CID 58447927) has the molecular formula C21H16N6O and a molecular weight of 368.40 g/mol. Its IUPAC name is N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide
PubChem CID58447927
Molecular FormulaC21H16N6O
Molecular Weight368.40 g/mol
Exact Mass368.14
IUPAC NameN-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide
SMILESO=C(Cc1ccc(-c2ccncc2)nc1)Nc1ccc(-c2cccnn2)cn1
InChIInChI=1S/C21H16N6O/c28-21(12-15-3-5-18(23-13-15)16-7-10-22-11-8-16)26-20-6-4-17(14-24-20)19-2-1-9-25-27-19/h1-11,13-14H,12H2,(H,24,26,28)
InChIKeySRPYYTPEVBKMBF-UHFFFAOYSA-N
XLogP3.18
TPSA93.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.40
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-phenylphenyl)-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
CID 167973654
2-[4-(2-fluoro-4-pyridinyl)phenyl]-N-(5-pyridin-2-yl-2-pyridinyl)acetamide
CID 90988265
N-[6-(3-fluorophenyl)-3-pyridinyl]-2-(5-methyl-6-pyridin-4-yl-3-pyridinyl)acetamide;2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-[6-(3-methylphenyl)-3-pyridinyl]acetamide;2-(5-methyl-6-pyridin-4-yl-3-pyridinyl)-N-(5-pyridin-2-yl-2-pyridinyl)acetamide;N-(5-pyridin-2-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide
CID 161125461
2-[4-pyridazin-4-yl-3-(trifluoromethyl)phenyl]-N-(5-pyridin-2-yl-2-pyridinyl)acetamide
CID 58447863
N-[(4-pyridazin-3-ylphenyl)methyl]prop-2-enamide
CID 66913132
N-(5-pyridin-4-yl-2-pyridinyl)acetamide
CID 102057434
2-(4-methylphenyl)-N-(5-phenyl-2-pyridinyl)acetamide
CID 90935995
N-(5-phenyl-2-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
CID 134313404
2-[4-(2-methyl-4-pyridinyl)phenyl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
CID 58447723
2-morpholin-4-yl-N-(3-pyridazin-3-yl-1,7-naphthyridin-6-yl)acetamide
CID 138588047
2-[5-fluoro-6-(2-fluoro-4-pyridinyl)-3-pyridinyl]-N-(5-pyrazin-2-yl-2-pyridinyl)acetamide
CID 46927365
2-[3-cyano-4-(2-fluoro-4-pyridinyl)phenyl]-N-(5-pyridin-2-yl-2-pyridinyl)acetamide
CID 58447671

Frequently Asked Questions

What is the IUPAC name of N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The IUPAC name of N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide (CID 58447927) is N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide.
What is the SMILES notation for N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The canonical SMILES for N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide is O=C(Cc1ccc(-c2ccncc2)nc1)Nc1ccc(-c2cccnn2)cn1.
What is the InChIKey of N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide?
The InChIKey is SRPYYTPEVBKMBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16N6O/c28-21(12-15-3-5-18(23-13-15)16-7-10-22-11-8-16)26-20-6-4-17(14-24-20)19-2-1-9-25-27-19/h1-11,13-14H,12H2,(H,24,26,28).
What are the key properties of N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide?
N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide has a molecular weight of 368.40 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-pyridazin-3-yl-2-pyridinyl)-2-(6-pyridin-4-yl-3-pyridinyl)acetamide is sourced from PubChem (CID 58447927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).