N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide

C20H17N5O — CID 47811081

IUPACN-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESN#Cc1cnn(-c2ccccc2)c1NC(=O)CN1CCc2ccccc21
InChIInChI=1S/C20H17N5O/c21-12-16-13-22-25(17-7-2-1-3-8-17)20(16)23-19(26)14-24-11-10-15-6-4-5-9-18(15)24/h1-9,13H,10-11,14H2,(H,23,26)
InChIKeyXTZBOYQTSNECBB-UHFFFAOYSA-N
MW343.39 g/mol
LogP2.75
Rot. Bonds4

About N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide

N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide (PubChem CID 47811081) has the molecular formula C20H17N5O and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide
PubChem CID47811081
Molecular FormulaC20H17N5O
Molecular Weight343.39 g/mol
Exact Mass343.14
IUPAC NameN-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide
SMILESN#Cc1cnn(-c2ccccc2)c1NC(=O)CN1CCc2ccccc21
InChIInChI=1S/C20H17N5O/c21-12-16-13-22-25(17-7-2-1-3-8-17)20(16)23-19(26)14-24-11-10-15-6-4-5-9-18(15)24/h1-9,13H,10-11,14H2,(H,23,26)
InChIKeyXTZBOYQTSNECBB-UHFFFAOYSA-N
XLogP2.75
TPSA73.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2-thiophen-2-ylpyrrolidin-1-yl)acetamide
CID 47811260
N-(4-cyano-1-phenylpyrazol-5-yl)-2-(4-cyclopentylpiperazin-1-yl)acetamide
CID 47083042
N-(4-cyano-1-phenylpyrazol-5-yl)-2-[4-(4-hydroxybenzoyl)piperidin-1-yl]acetamide
CID 86860813
2-(2,3-dihydroindol-1-yl)-N-phenylacetamide
CID 22199878
N-(4-cyano-1-phenylpyrazol-5-yl)-2-[(2R)-2-[(1R,2R)-2-hydroxycyclohexyl]piperidin-1-yl]acetamide
CID 124742043
N-(4-cyano-1-phenylpyrazol-5-yl)-2-(3-methyl-5-nitropyrazol-1-yl)acetamide
CID 19530657
N-(4-cyano-1-phenylpyrazol-5-yl)-2-[3-(difluoromethyl)-5-methylpyrazol-1-yl]acetamide
CID 19519557
2-[[2-(2,3-dihydroindol-1-yl)acetyl]amino]acetic acid
CID 82041294
N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 9432348
N-(4-cyano-1-phenylpyrazol-5-yl)-2-(5-methyl-3,4-dinitropyrazol-1-yl)acetamide
CID 19530055
N-(5-bromo-2-pyridinyl)-2-(2,3-dihydroindol-1-yl)acetamide
CID 17376673
2-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]-N-(4-cyano-1-phenylpyrazol-5-yl)acetamide
CID 19523494

Frequently Asked Questions

What is the IUPAC name of N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide?
The IUPAC name of N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide (CID 47811081) is N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide.
What is the SMILES notation for N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide?
The canonical SMILES for N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide is N#Cc1cnn(-c2ccccc2)c1NC(=O)CN1CCc2ccccc21.
What is the InChIKey of N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide?
The InChIKey is XTZBOYQTSNECBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O/c21-12-16-13-22-25(17-7-2-1-3-8-17)20(16)23-19(26)14-24-11-10-15-6-4-5-9-18(15)24/h1-9,13H,10-11,14H2,(H,23,26).
What are the key properties of N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide?
N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide has a molecular weight of 343.39 g/mol, XLogP of 2.75, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyano-1-phenylpyrazol-5-yl)-2-(2,3-dihydroindol-1-yl)acetamide is sourced from PubChem (CID 47811081), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).