N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide

C25H19N5O2 — CID 134313469

IUPACN-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
SMILESO=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccoc2)cc1
InChIInChI=1S/C25H19N5O2/c31-24(27-21-8-6-18(7-9-21)20-12-15-32-17-20)16-23-25(19-4-2-1-3-5-19)30(29-28-23)22-10-13-26-14-11-22/h1-15,17H,16H2,(H,27,31)
InChIKeyXCBXDNSAZYIUBD-UHFFFAOYSA-N
MW421.46 g/mol
LogP4.77
Rot. Bonds6

About N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide

N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide (PubChem CID 134313469) has the molecular formula C25H19N5O2 and a molecular weight of 421.46 g/mol. Its IUPAC name is N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
PubChem CID134313469
Molecular FormulaC25H19N5O2
Molecular Weight421.46 g/mol
Exact Mass421.15
IUPAC NameN-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
SMILESO=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccoc2)cc1
InChIInChI=1S/C25H19N5O2/c31-24(27-21-8-6-18(7-9-21)20-12-15-32-17-20)16-23-25(19-4-2-1-3-5-19)30(29-28-23)22-10-13-26-14-11-22/h1-15,17H,16H2,(H,27,31)
InChIKeyXCBXDNSAZYIUBD-UHFFFAOYSA-N
XLogP4.77
TPSA85.84 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.46
LogP ≤ 54.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(6-phenyl-3-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
CID 134313454
N-(5-phenyl-2-pyridinyl)-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide
CID 134313404
2-[5-(4-methylphenyl)-1-pyridin-4-yltriazol-4-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 138742074
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-(5-phenyl-1-pyridin-4-yltriazol-4-yl)-N-(5-piperidin-1-yl-2-pyridinyl)acetamide
CID 134313500
2-[1-(2-methyl-4-pyridinyl)-5-phenyltriazol-4-yl]-N-(5-phenyl-2-pyridinyl)acetamide
CID 134313416
2-anilino-N-(4-pyridin-4-ylphenyl)acetamide
CID 15981382
N-(5-phenyl-2-pyridinyl)-2-[5-phenyl-1-[2-(trifluoromethyl)phenyl]triazol-4-yl]acetamide
CID 134313414
2-(5-phenyl-4-pyridin-4-yltriazol-1-yl)-N-(4-pyridin-3-ylphenyl)acetamide
CID 134136406
N-(4-hydroxyphenyl)-2-(4-phenylphenyl)acetamide
CID 71422853
2-[4-[4-(aminomethyl)-5-pyridin-4-yltriazol-1-yl]phenyl]acetic acid
CID 94935955

Frequently Asked Questions

What is the IUPAC name of N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The IUPAC name of N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide (CID 134313469) is N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide.
What is the SMILES notation for N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The canonical SMILES for N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide is O=C(Cc1nnn(-c2ccncc2)c1-c1ccccc1)Nc1ccc(-c2ccoc2)cc1.
What is the InChIKey of N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
The InChIKey is XCBXDNSAZYIUBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H19N5O2/c31-24(27-21-8-6-18(7-9-21)20-12-15-32-17-20)16-23-25(19-4-2-1-3-5-19)30(29-28-23)22-10-13-26-14-11-22/h1-15,17H,16H2,(H,27,31).
What are the key properties of N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide?
N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide has a molecular weight of 421.46 g/mol, XLogP of 4.77, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(furan-3-yl)phenyl]-2-(5-phenyl-1-pyridin-4-yltriazol-4-yl)acetamide is sourced from PubChem (CID 134313469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).