N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide

C26H20N6O — CID 134313454

IUPACN-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
SMILESO=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C26H20N6O/c33-25(29-21-11-12-23(28-18-21)19-7-3-1-4-8-19)17-24-26(20-9-5-2-6-10-20)32(31-30-24)22-13-15-27-16-14-22/h1-16,18H,17H2,(H,29,33)
InChIKeyQHBNXPDKMJEQCI-UHFFFAOYSA-N
MW432.49 g/mol
LogP4.57
Rot. Bonds6

About N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide

N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide (PubChem CID 134313454) has the molecular formula C26H20N6O and a molecular weight of 432.49 g/mol. Its IUPAC name is N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
PubChem CID134313454
Molecular FormulaC26H20N6O
Molecular Weight432.49 g/mol
Exact Mass432.17
IUPAC NameN-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
SMILESO=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccccc2)nc1
InChIInChI=1S/C26H20N6O/c33-25(29-21-11-12-23(28-18-21)19-7-3-1-4-8-19)17-24-26(20-9-5-2-6-10-20)32(31-30-24)22-13-15-27-16-14-22/h1-16,18H,17H2,(H,29,33)
InChIKeyQHBNXPDKMJEQCI-UHFFFAOYSA-N
XLogP4.57
TPSA85.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.49
LogP ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(5-phenyl-2-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
CID 134313404
N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
CID 134313469
2-[5-(4-methylphenyl)-1-pyridin-4-yltriazol-4-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 138742074
2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)-N-(5-piperidin-1-yl-2-pyridinyl)acetamide
CID 134313500
2-[5-(4-methoxyphenyl)-1-pyridin-4-yltriazol-4-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 134313451
2-(5-methyl-1-phenyltriazol-4-yl)-N-pyridin-4-ylacetamide
CID 146124225
2-[1-(2-methyl-4-pyridinyl)-5-phenyltriazol-4-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 134313416
2-(3,4-dimethoxyphenyl)-N-(6-phenyl-3-pyridinyl)acetamide
CID 110634746
N-(5-phenyl-2-pyridinyl)-2-[5-phenyl-1-[2-(trifluoromethyl)phenyl]triazol-4-yl]acetamide
CID 134313414
2-[4-[4-(aminomethyl)-5-pyridin-4-yltriazol-1-yl]phenyl]acetic acid
CID 94935955
2-[5-methyl-6-(2-methyl-4-pyridinyl)-3-pyridinyl]-N-(6-pyridin-4-yl-3-pyridinyl)acetamide
CID 58447768
2-[1-(3-methylphenyl)-5-phenyltriazol-4-yl]acetic acid
CID 82198087

Frequently Asked Questions

What is the IUPAC name of N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The IUPAC name of N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide (CID 134313454) is N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide.
What is the SMILES notation for N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The canonical SMILES for N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide is O=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccccc2)nc1.
What is the InChIKey of N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The InChIKey is QHBNXPDKMJEQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H20N6O/c33-25(29-21-11-12-23(28-18-21)19-7-3-1-4-8-19)17-24-26(20-9-5-2-6-10-20)32(31-30-24)22-13-15-27-16-14-22/h1-16,18H,17H2,(H,29,33).
What are the key properties of N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide has a molecular weight of 432.49 g/mol, XLogP of 4.57, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide is sourced from PubChem (CID 134313454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).