N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide

C23H20N4O3 — CID 55764173

IUPACN-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)Cc2cnn(-c3ccccc3)c2)cc1
InChIInChI=1S/C23H20N4O3/c1-29-19-9-11-20(12-10-19)30-23-21(8-5-13-24-23)26-22(28)14-17-15-25-27(16-17)18-6-3-2-4-7-18/h2-13,15-16H,14H2,1H3,(H,26,28)
InChIKeyDHPZRVQILYPYGU-UHFFFAOYSA-N
MW400.44 g/mol
LogP4.25
Rot. Bonds7

About N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide

N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide (PubChem CID 55764173) has the molecular formula C23H20N4O3 and a molecular weight of 400.44 g/mol. Its IUPAC name is N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide.

Molecular Properties

Compound NameN-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide
PubChem CID55764173
Molecular FormulaC23H20N4O3
Molecular Weight400.44 g/mol
Exact Mass400.15
IUPAC NameN-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide
SMILESCOc1ccc(Oc2ncccc2NC(=O)Cc2cnn(-c3ccccc3)c2)cc1
InChIInChI=1S/C23H20N4O3/c1-29-19-9-11-20(12-10-19)30-23-21(8-5-13-24-23)26-22(28)14-17-15-25-27(16-17)18-6-3-2-4-7-18/h2-13,15-16H,14H2,1H3,(H,26,28)
InChIKeyDHPZRVQILYPYGU-UHFFFAOYSA-N
XLogP4.25
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.44
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-pyrrol-1-ylphenyl)acetamide
CID 55764141
N-[2-[(3,5-dichloro-2-pyridinyl)oxy]phenyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 55727529
2-(1-phenylpyrazol-4-yl)-N-(2-pyrazol-1-yl-3-pyridinyl)acetamide
CID 39166946
N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 154411578
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-oxocinnolin-1-yl)acetamide
CID 55763290
N-[2,5-dimethoxy-4-[[2-(1-phenylpyrazol-4-yl)acetyl]amino]phenyl]benzamide
CID 16614506
2-(1-phenylpyrazol-4-yl)-N-pyridin-4-ylacetamide
CID 18152814
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 55661128
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-[(3-methylphenyl)methylsulfanyl]acetamide
CID 55661370
2-(5-bromo-2-oxo-1-pyridinyl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]acetamide
CID 55763738
4-(1,3-dioxoisoindol-2-yl)-N-[2-(4-methoxyphenoxy)-3-pyridinyl]butanamide
CID 55661422
N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]-2-(1-phenylpyrazol-4-yl)acetamide
CID 16621818

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The IUPAC name of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide (CID 55764173) is N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide.
What is the SMILES notation for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The canonical SMILES for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide is COc1ccc(Oc2ncccc2NC(=O)Cc2cnn(-c3ccccc3)c2)cc1.
What is the InChIKey of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide?
The InChIKey is DHPZRVQILYPYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N4O3/c1-29-19-9-11-20(12-10-19)30-23-21(8-5-13-24-23)26-22(28)14-17-15-25-27(16-17)18-6-3-2-4-7-18/h2-13,15-16H,14H2,1H3,(H,26,28).
What are the key properties of N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide?
N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide has a molecular weight of 400.44 g/mol, XLogP of 4.25, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-methoxyphenoxy)-3-pyridinyl]-2-(1-phenylpyrazol-4-yl)acetamide is sourced from PubChem (CID 55764173), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).