N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide

C17H16N4O2 — CID 100820011

IUPACN-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide
SMILESCc1ccc(NC(=O)COc2ccn(-c3ccccc3)n2)nc1
InChIInChI=1S/C17H16N4O2/c1-13-7-8-15(18-11-13)19-16(22)12-23-17-9-10-21(20-17)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,18,19,22)
InChIKeyDWHLPWOUCDMKFX-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.59
Rot. Bonds5

About N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide

N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide (PubChem CID 100820011) has the molecular formula C17H16N4O2 and a molecular weight of 308.34 g/mol. Its IUPAC name is N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide.

Molecular Properties

Compound NameN-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide
PubChem CID100820011
Molecular FormulaC17H16N4O2
Molecular Weight308.34 g/mol
Exact Mass308.13
IUPAC NameN-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide
SMILESCc1ccc(NC(=O)COc2ccn(-c3ccccc3)n2)nc1
InChIInChI=1S/C17H16N4O2/c1-13-7-8-15(18-11-13)19-16(22)12-23-17-9-10-21(20-17)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,18,19,22)
InChIKeyDWHLPWOUCDMKFX-UHFFFAOYSA-N
XLogP2.59
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1-phenylpyrazol-3-yl)oxy-N-propan-2-ylacetamide
CID 100820004
N-butan-2-yl-2-(1-phenylpyrazol-3-yl)oxyacetamide
CID 171133241
N-(3-hydroxypropyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide
CID 100820014
2-(2-benzylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
CID 60521789
2-benzhydrylsulfanyl-N-(5-methyl-2-pyridinyl)acetamide
CID 46651551
N-[(2-ethyl-1,3-thiazol-4-yl)methyl]-2-(1-phenylpyrazol-3-yl)oxyacetamide
CID 100820000
2-(2,3-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
CID 35022382
2-(2,4-dimethylphenoxy)-N-(5-methyl-2-pyridinyl)acetamide
CID 837547
N-(5-methyl-2-pyridinyl)-2-(2-nitrophenoxy)acetamide
CID 2319869
3-(4-methylphenyl)-N-(1-phenylpyrazol-3-yl)propanamide
CID 55536355
N-(5-methyl-2-pyridinyl)-4-oxo-4-phenylbutanamide
CID 35022311
N-(5-methyl-2-pyridinyl)-2-(2,3,5,6-tetrafluorophenoxy)acetamide
CID 681610

Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide?
The IUPAC name of N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide (CID 100820011) is N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide.
What is the SMILES notation for N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide?
The canonical SMILES for N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide is Cc1ccc(NC(=O)COc2ccn(-c3ccccc3)n2)nc1.
What is the InChIKey of N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide?
The InChIKey is DWHLPWOUCDMKFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4O2/c1-13-7-8-15(18-11-13)19-16(22)12-23-17-9-10-21(20-17)14-5-3-2-4-6-14/h2-11H,12H2,1H3,(H,18,19,22).
What are the key properties of N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide?
N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide has a molecular weight of 308.34 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-2-pyridinyl)-2-(1-phenylpyrazol-3-yl)oxyacetamide is sourced from PubChem (CID 100820011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).