N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide

C18H24N4O — CID 156585386

IUPACN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide
SMILESCCc1c(NC(=O)CN2CCC(c3ccccc3)C2)n[nH]c1C
InChIInChI=1S/C18H24N4O/c1-3-16-13(2)20-21-18(16)19-17(23)12-22-10-9-15(11-22)14-7-5-4-6-8-14/h4-8,15H,3,9-12H2,1-2H3,(H2,19,20,21,23)
InChIKeyZWJDDIYLRIZSCU-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.71
Rot. Bonds5

About N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide

N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide (PubChem CID 156585386) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide
PubChem CID156585386
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC NameN-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide
SMILESCCc1c(NC(=O)CN2CCC(c3ccccc3)C2)n[nH]c1C
InChIInChI=1S/C18H24N4O/c1-3-16-13(2)20-21-18(16)19-17(23)12-22-10-9-15(11-22)14-7-5-4-6-8-14/h4-8,15H,3,9-12H2,1-2H3,(H2,19,20,21,23)
InChIKeyZWJDDIYLRIZSCU-UHFFFAOYSA-N
XLogP2.71
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-pentyl-2-[(3S)-3-phenylpyrrolidin-1-yl]acetamide
CID 95317674
N-[(2R)-3-methylbutan-2-yl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95280817
2-(3-phenylpyrrolidin-1-yl)-N-prop-2-ynylacetamide
CID 78983867
N-(2-hydroxyethyl)-2-(3-phenylpyrrolidin-1-yl)acetamide
CID 62133590
N-cyclopropyl-N-ethyl-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95338399
N-[(1R)-1-cyclopropylethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95321250
N-[2-(2-methylphenyl)ethyl]-2-[(3R)-3-phenylpyrrolidin-1-yl]acetamide
CID 95333668
2-[(3R)-3-phenylpyrrolidin-1-yl]-N-(2,2,2-trifluoroethyl)acetamide
CID 95317472
1-(2,5-dimethyl-1H-pyrrol-3-yl)-2-(3-phenylpyrrolidin-1-yl)ethanone
CID 62070394
2-(4-phenylpiperidin-1-yl)-N-propylacetamide
CID 134001849
1-[[2-(3-phenylpyrrolidin-1-yl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 91842994
N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-[3-(phenylsulfanylmethyl)pyrrolidin-1-yl]acetamide
CID 71988673

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide?
The IUPAC name of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide (CID 156585386) is N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide is CCc1c(NC(=O)CN2CCC(c3ccccc3)C2)n[nH]c1C.
What is the InChIKey of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide?
The InChIKey is ZWJDDIYLRIZSCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-3-16-13(2)20-21-18(16)19-17(23)12-22-10-9-15(11-22)14-7-5-4-6-8-14/h4-8,15H,3,9-12H2,1-2H3,(H2,19,20,21,23).
What are the key properties of N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide?
N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide has a molecular weight of 312.42 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-5-methyl-1H-pyrazol-3-yl)-2-(3-phenylpyrrolidin-1-yl)acetamide is sourced from PubChem (CID 156585386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).