2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide

C19H16N4O3 — CID 51098942

IUPAC2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCOc1ccccc1-c1cc(NC(=O)COc2ccc(C#N)cc2)n[nH]1
InChIInChI=1S/C19H16N4O3/c1-25-17-5-3-2-4-15(17)16-10-18(23-22-16)21-19(24)12-26-14-8-6-13(11-20)7-9-14/h2-10H,12H2,1H3,(H2,21,22,23,24)
InChIKeyBCUNTRLFFGOIGX-UHFFFAOYSA-N
MW348.36 g/mol
LogP2.97
Rot. Bonds6

About 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide

2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide (PubChem CID 51098942) has the molecular formula C19H16N4O3 and a molecular weight of 348.36 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
PubChem CID51098942
Molecular FormulaC19H16N4O3
Molecular Weight348.36 g/mol
Exact Mass348.12
IUPAC Name2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide
SMILESCOc1ccccc1-c1cc(NC(=O)COc2ccc(C#N)cc2)n[nH]1
InChIInChI=1S/C19H16N4O3/c1-25-17-5-3-2-4-15(17)16-10-18(23-22-16)21-19(24)12-26-14-8-6-13(11-20)7-9-14/h2-10H,12H2,1H3,(H2,21,22,23,24)
InChIKeyBCUNTRLFFGOIGX-UHFFFAOYSA-N
XLogP2.97
TPSA100.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-methylbutanamide
CID 56552764
2-bromo-5-methoxy-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]benzamide
CID 56552729
N-(5-chloro-2-methoxyphenyl)-2-(4-cyanophenoxy)acetamide
CID 7503472
N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-3-methylfuran-2-carboxamide
CID 51099249
N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-2-(pyridin-2-ylmethylsulfanyl)acetamide
CID 51128562
N-(5-acetamido-2-methoxyphenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 9019861
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
2-(4-cyanophenoxy)-N-(5-fluoro-2-methylphenyl)acetamide
CID 7961641
4-fluoro-2-iodo-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]benzamide
CID 56552510
N-[4-(2-chlorophenyl)-1,3-thiazol-2-yl]-2-(4-cyanophenoxy)acetamide
CID 2428133
4-bromo-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]-5-propan-2-yl-1H-pyrazole-3-carboxamide
CID 56566131
(2S)-2-(3-chlorophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]propanamide
CID 52792045

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide (CID 51098942) is 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide is COc1ccccc1-c1cc(NC(=O)COc2ccc(C#N)cc2)n[nH]1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
The InChIKey is BCUNTRLFFGOIGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3/c1-25-17-5-3-2-4-15(17)16-10-18(23-22-16)21-19(24)12-26-14-8-6-13(11-20)7-9-14/h2-10H,12H2,1H3,(H2,21,22,23,24).
What are the key properties of 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide?
2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide has a molecular weight of 348.36 g/mol, XLogP of 2.97, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-[5-(2-methoxyphenyl)-1H-pyrazol-3-yl]acetamide is sourced from PubChem (CID 51098942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).