N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide

C19H19N3O2 — CID 53382546

IUPACN-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide
SMILESCc1cnn(-c2ccccc2)c1NC(=O)COCc1ccccc1
InChIInChI=1S/C19H19N3O2/c1-15-12-20-22(17-10-6-3-7-11-17)19(15)21-18(23)14-24-13-16-8-4-2-5-9-16/h2-12H,13-14H2,1H3,(H,21,23)
InChIKeyBAKKLMUDLNRUOY-UHFFFAOYSA-N
MW321.38 g/mol
LogP3.34
Rot. Bonds6

About N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide

N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide (PubChem CID 53382546) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide.

Molecular Properties

Compound NameN-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide
PubChem CID53382546
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide
SMILESCc1cnn(-c2ccccc2)c1NC(=O)COCc1ccccc1
InChIInChI=1S/C19H19N3O2/c1-15-12-20-22(17-10-6-3-7-11-17)19(15)21-18(23)14-24-13-16-8-4-2-5-9-16/h2-12H,13-14H2,1H3,(H,21,23)
InChIKeyBAKKLMUDLNRUOY-UHFFFAOYSA-N
XLogP3.34
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-tert-butyl-1-(4-methylphenyl)pyrazol-5-yl]-2-[2-methoxyethyl-(2-phenylmethoxyacetyl)amino]acetamide
CID 45488376
US10351575, Example 8
CID 90169246
[2-[(3-Tert-butyl-1-phenylpyrazol-5-yl)amino]-2-oxoethyl] benzoate
CID 4803443
2-ethoxy-2-phenyl-N-(1-phenylpyrazol-3-yl)acetamide
CID 47721668
2-ethoxy-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
CID 56789802
2-(2-ethoxyethoxy)-N-[2-(2-methylphenyl)pyrazol-3-yl]propanamide
CID 72136031
2-[benzyl-(2-phenylmethoxyacetyl)amino]-N-[1-(4-fluorophenyl)-3-phenylpyrazol-5-yl]acetamide
CID 3943622
2-(Benzyloxy)-N-({[1-(4-fluorophenyl)-3-phenyl-1H-pyrazol-5-YL]carbamoyl}methyl)-N-(2-methylpropyl)acetamide
CID 4422967
N-{1-[1-(4-fluorobenzyl)-4-piperidinyl]-1H-pyrazol-5-yl}-2-methoxy-2-phenylacetamide
CID 45226115
N-(3-fluorophenyl)-N'-(1-{1-[methoxy(phenyl)acetyl]-4-piperidinyl}-1H-pyrazol-5-yl)urea
CID 45247638
4-Fluoro-11-methyl-18-(methylamino)-9-oxa-2,12,16,17,20-pentazatetracyclo[12.5.2.13,7.017,21]docosa-3,5,7(22),14(21),15,18-hexaen-13-one
CID 155692183
N-[4-(4,5-dihydro-1,3-oxazol-2-yl)-1-(4-fluorophenyl)pyrazol-5-yl]-2-hydroxy-2-phenylacetamide
CID 166068114

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide?
The IUPAC name of N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide (CID 53382546) is N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide.
What is the SMILES notation for N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide?
The canonical SMILES for N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide is Cc1cnn(-c2ccccc2)c1NC(=O)COCc1ccccc1.
What is the InChIKey of N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide?
The InChIKey is BAKKLMUDLNRUOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-15-12-20-22(17-10-6-3-7-11-17)19(15)21-18(23)14-24-13-16-8-4-2-5-9-16/h2-12H,13-14H2,1H3,(H,21,23).
What are the key properties of N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide?
N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide has a molecular weight of 321.38 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1-phenylpyrazol-5-yl)-2-phenylmethoxyacetamide is sourced from PubChem (CID 53382546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).