4-pyrazol-1-yl-N-pyridin-4-ylbenzamide

C15H12N4O — CID 27700232

IUPAC4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C15H12N4O/c20-15(18-13-6-9-16-10-7-13)12-2-4-14(5-3-12)19-11-1-8-17-19/h1-11H,(H,16,18,20)
InChIKeyLVLLBFXCMOTEJU-UHFFFAOYSA-N
MW264.29 g/mol
LogP2.52
Rot. Bonds3

About 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide

4-pyrazol-1-yl-N-pyridin-4-ylbenzamide (PubChem CID 27700232) has the molecular formula C15H12N4O and a molecular weight of 264.29 g/mol. Its IUPAC name is 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide.

Molecular Properties

Compound Name4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
PubChem CID27700232
Molecular FormulaC15H12N4O
Molecular Weight264.29 g/mol
Exact Mass264.10
IUPAC Name4-pyrazol-1-yl-N-pyridin-4-ylbenzamide
SMILESO=C(Nc1ccncc1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C15H12N4O/c20-15(18-13-6-9-16-10-7-13)12-2-4-14(5-3-12)19-11-1-8-17-19/h1-11H,(H,16,18,20)
InChIKeyLVLLBFXCMOTEJU-UHFFFAOYSA-N
XLogP2.52
TPSA59.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-difluorophenyl)-4-pyrazol-1-ylbenzamide
CID 17426566
N-(3,5-dichlorophenyl)-4-pyrazol-1-ylbenzamide
CID 46813346
propan-2-yl 4-[(4-pyrazol-1-ylbenzoyl)amino]benzoate
CID 17497737
N-[4-(2-hydroxyethoxy)phenyl]-4-pyrazol-1-ylbenzamide
CID 111116155
4-pyrazol-1-yl-N-[3-(1H-pyrazol-5-yl)phenyl]benzamide
CID 37044281
N-(1H-indazol-6-yl)-4-pyrazol-1-ylbenzamide
CID 36561549
3-bromo-N-(4-pyrazol-1-ylphenyl)benzamide
CID 35761421
3-amino-4-methyl-N-(4-pyrazol-1-ylphenyl)benzamide
CID 35275378
4-pyrazol-1-yl-N-[4-[2-(1,2,4-triazol-1-yl)propanoylamino]phenyl]benzamide
CID 43071024
4-(1,1-dioxo-1,2-thiazolidin-2-yl)-N-(4-pyrazol-1-ylphenyl)benzamide
CID 78866605
N-(1H-imidazol-2-yl)-4-pyrazol-1-ylbenzamide
CID 60968230
3-chloro-N-(4-pyrazol-1-ylphenyl)pyridine-4-carboxamide
CID 66483325

Frequently Asked Questions

What is the IUPAC name of 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide?
The IUPAC name of 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide (CID 27700232) is 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide.
What is the SMILES notation for 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide?
The canonical SMILES for 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide is O=C(Nc1ccncc1)c1ccc(-n2cccn2)cc1.
What is the InChIKey of 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide?
The InChIKey is LVLLBFXCMOTEJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N4O/c20-15(18-13-6-9-16-10-7-13)12-2-4-14(5-3-12)19-11-1-8-17-19/h1-11H,(H,16,18,20).
What are the key properties of 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide?
4-pyrazol-1-yl-N-pyridin-4-ylbenzamide has a molecular weight of 264.29 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrazol-1-yl-N-pyridin-4-ylbenzamide is sourced from PubChem (CID 27700232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).