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

C22H19N3O3 — CID 42687652

IUPACN-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2c(-c3ccccc3)n[nH]c2-c2ccco2)cc1
InChIInChI=1S/C22H19N3O3/c1-27-17-11-9-15(10-12-17)14-19(26)23-22-20(16-6-3-2-4-7-16)24-25-21(22)18-8-5-13-28-18/h2-13H,14H2,1H3,(H,23,26)(H,24,25)
InChIKeyYXMHGUYVKHYCFQ-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.53
Rot. Bonds6

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

N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide (PubChem CID 42687652) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
PubChem CID42687652
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC NameN-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(CC(=O)Nc2c(-c3ccccc3)n[nH]c2-c2ccco2)cc1
InChIInChI=1S/C22H19N3O3/c1-27-17-11-9-15(10-12-17)14-19(26)23-22-20(16-6-3-2-4-7-16)24-25-21(22)18-8-5-13-28-18/h2-13H,14H2,1H3,(H,23,26)(H,24,25)
InChIKeyYXMHGUYVKHYCFQ-UHFFFAOYSA-N
XLogP4.53
TPSA80.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-3-methoxybenzamide
CID 42687656
2-(4-methoxyphenyl)-N-[3-(4-methoxyphenyl)-5-methyl-1H-pyrazol-4-yl]acetamide
CID 42687579
2,6-difluoro-N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]benzamide
CID 42687666
N-[3-(3-methoxyphenyl)-5-propyl-1H-pyrazol-4-yl]-2-phenylacetamide
CID 42686943
N-[3-(4-chlorophenyl)-5-propyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
CID 42685933
N-(3,5-diphenyl-1H-pyrazol-4-yl)propanamide
CID 42687176
N-[[3-(furan-2-yl)-1H-1,2,4-triazol-5-yl]methyl]-2-(4-methoxyphenyl)acetamide
CID 56827435
N-[5-(furan-2-yl)-1H-1,2,4-triazol-3-yl]-3-(4-methoxyphenyl)propanamide
CID 154770900
N-[2-[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]phenyl]-2-(4-methoxyphenyl)acetamide
CID 30332601
N-(4,5-diphenyltriazol-1-yl)-2-(4-methoxyphenyl)acetamide
CID 12568896
N-[[5-(furan-2-yl)-3-pyridinyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 121196995
N-[3-(2,5-dimethoxyphenyl)-5-methyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide
CID 42685763

Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide?
The IUPAC name of N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide (CID 42687652) is N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide.
What is the SMILES notation for N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide?
The canonical SMILES for N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide is COc1ccc(CC(=O)Nc2c(-c3ccccc3)n[nH]c2-c2ccco2)cc1.
What is the InChIKey of N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide?
The InChIKey is YXMHGUYVKHYCFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c1-27-17-11-9-15(10-12-17)14-19(26)23-22-20(16-6-3-2-4-7-16)24-25-21(22)18-8-5-13-28-18/h2-13H,14H2,1H3,(H,23,26)(H,24,25).
What are the key properties of N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide?
N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide has a molecular weight of 373.41 g/mol, XLogP of 4.53, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-yl)-3-phenyl-1H-pyrazol-4-yl]-2-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 42687652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).