N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide

C20H15N5O2 — CID 60525572

IUPACN-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1ccnc(-n2cncn2)c1
InChIInChI=1S/C20H15N5O2/c26-20(15-10-11-22-19(12-15)25-14-21-13-23-25)24-17-8-4-5-9-18(17)27-16-6-2-1-3-7-16/h1-14H,(H,24,26)
InChIKeyGLXCFDSDRHLDQB-UHFFFAOYSA-N
MW357.37 g/mol
LogP3.71
Rot. Bonds5

About N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide

N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide (PubChem CID 60525572) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
PubChem CID60525572
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC NameN-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
SMILESO=C(Nc1ccccc1Oc1ccccc1)c1ccnc(-n2cncn2)c1
InChIInChI=1S/C20H15N5O2/c26-20(15-10-11-22-19(12-15)25-14-21-13-23-25)24-17-8-4-5-9-18(17)27-16-6-2-1-3-7-16/h1-14H,(H,24,26)
InChIKeyGLXCFDSDRHLDQB-UHFFFAOYSA-N
XLogP3.71
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-phenoxyphenyl)-2-pyrrolidin-1-ylpyridine-4-carboxamide
CID 109166024
2-methylsulfanyl-N-(2-phenoxyphenyl)pyridine-4-carboxamide
CID 60564666
2-N,2-N-diethyl-4-N-(2-phenoxyphenyl)pyridine-2,4-dicarboxamide
CID 109088996
N-[[4-(4-fluorophenoxy)phenyl]methyl]-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 60525782
N-[2-(4-methylphenoxy)phenyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide
CID 38506829
N-(4-chloro-2,6-difluorophenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 154751807
N-[(4-ethoxyphenyl)-phenylmethyl]-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 60526029
2-(1,2,4-triazol-1-yl)-N-(3,3,3-trifluoro-1-phenylpropyl)pyridine-4-carboxamide
CID 47070462
N-[(1S)-1-(3-propan-2-yloxyphenyl)ethyl]-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 51966121
N-[furan-2-yl(phenyl)methyl]-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide
CID 51091733
3,4-dihydroxy-N-(2-phenoxyphenyl)benzamide
CID 113199337
2-fluoro-N-[2-(4-methylphenoxy)phenyl]pyridine-4-carboxamide
CID 60565493

Frequently Asked Questions

What is the IUPAC name of N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide?
The IUPAC name of N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide (CID 60525572) is N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide.
What is the SMILES notation for N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide?
The canonical SMILES for N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide is O=C(Nc1ccccc1Oc1ccccc1)c1ccnc(-n2cncn2)c1.
What is the InChIKey of N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide?
The InChIKey is GLXCFDSDRHLDQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c26-20(15-10-11-22-19(12-15)25-14-21-13-23-25)24-17-8-4-5-9-18(17)27-16-6-2-1-3-7-16/h1-14H,(H,24,26).
What are the key properties of N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide?
N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide has a molecular weight of 357.37 g/mol, XLogP of 3.71, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-4-carboxamide is sourced from PubChem (CID 60525572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).