4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide

C23H20N4O2 — CID 46470263

IUPAC4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1cccc(OCc2ccccn2)c1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C23H20N4O2/c28-23(19-8-10-21(11-9-19)27-14-4-13-26-27)25-16-18-5-3-7-22(15-18)29-17-20-6-1-2-12-24-20/h1-15H,16-17H2,(H,25,28)
InChIKeyARWQVZZQLRLMQP-UHFFFAOYSA-N
MW384.44 g/mol
LogP3.78
Rot. Bonds7

About 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide

4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide (PubChem CID 46470263) has the molecular formula C23H20N4O2 and a molecular weight of 384.44 g/mol. Its IUPAC name is 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide.

Molecular Properties

Compound Name4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
PubChem CID46470263
Molecular FormulaC23H20N4O2
Molecular Weight384.44 g/mol
Exact Mass384.16
IUPAC Name4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
SMILESO=C(NCc1cccc(OCc2ccccn2)c1)c1ccc(-n2cccn2)cc1
InChIInChI=1S/C23H20N4O2/c28-23(19-8-10-21(11-9-19)27-14-4-13-26-27)25-16-18-5-3-7-22(15-18)29-17-20-6-1-2-12-24-20/h1-15H,16-17H2,(H,25,28)
InChIKeyARWQVZZQLRLMQP-UHFFFAOYSA-N
XLogP3.78
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.44
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-pyrazol-1-yl-N-(pyridin-2-ylmethyl)benzamide
CID 40673388
4-(methylsulfanylmethyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 55709365
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 55709579
4-(3,5-dimethylpiperidin-1-yl)sulfonyl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 46467134
N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 46470158
5-chloro-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]thiophene-2-carboxamide
CID 46470172
2-methoxy-5-methyl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide
CID 55709278
5-(methoxymethyl)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 78875904
2-[(4-fluorophenyl)methylcarbamoylamino]-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 46467325
N-benzyl-3-pyrazol-1-ylbenzamide
CID 110698131
N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]-6,7,8,9-tetrahydro-5H-carbazole-1-carboxamide
CID 46477911
2-(2,6-dimethylphenoxy)-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]acetamide
CID 46478039

Frequently Asked Questions

What is the IUPAC name of 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide?
The IUPAC name of 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide (CID 46470263) is 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide.
What is the SMILES notation for 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide?
The canonical SMILES for 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide is O=C(NCc1cccc(OCc2ccccn2)c1)c1ccc(-n2cccn2)cc1.
What is the InChIKey of 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide?
The InChIKey is ARWQVZZQLRLMQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O2/c28-23(19-8-10-21(11-9-19)27-14-4-13-26-27)25-16-18-5-3-7-22(15-18)29-17-20-6-1-2-12-24-20/h1-15H,16-17H2,(H,25,28).
What are the key properties of 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide?
4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide has a molecular weight of 384.44 g/mol, XLogP of 3.78, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-pyrazol-1-yl-N-[[3-(pyridin-2-ylmethoxy)phenyl]methyl]benzamide is sourced from PubChem (CID 46470263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).