N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide

C21H20N4O2 — CID 53195937

IUPACN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide
SMILESCCn1c(-c2cc(NC(=O)COc3ccccc3)n[nH]2)cc2ccccc21
InChIInChI=1S/C21H20N4O2/c1-2-25-18-11-7-6-8-15(18)12-19(25)17-13-20(24-23-17)22-21(26)14-27-16-9-4-3-5-10-16/h3-13H,2,14H2,1H3,(H2,22,23,24,26)
InChIKeyDWAMHZNBCVKEAK-UHFFFAOYSA-N
MW360.42 g/mol
LogP4.07
Rot. Bonds6

About N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide

N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide (PubChem CID 53195937) has the molecular formula C21H20N4O2 and a molecular weight of 360.42 g/mol. Its IUPAC name is N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide
PubChem CID53195937
Molecular FormulaC21H20N4O2
Molecular Weight360.42 g/mol
Exact Mass360.16
IUPAC NameN-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide
SMILESCCn1c(-c2cc(NC(=O)COc3ccccc3)n[nH]2)cc2ccccc21
InChIInChI=1S/C21H20N4O2/c1-2-25-18-11-7-6-8-15(18)12-19(25)17-13-20(24-23-17)22-21(26)14-27-16-9-4-3-5-10-16/h3-13H,2,14H2,1H3,(H2,22,23,24,26)
InChIKeyDWAMHZNBCVKEAK-UHFFFAOYSA-N
XLogP4.07
TPSA71.94 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 54.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-(3-methoxyphenyl)acetamide
CID 53196168
N-[5-(1-ethyl-5-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxypropanamide
CID 53196011
N-(5-methyl-1H-pyrazol-3-yl)-2-phenoxyacetamide
CID 47148567
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-phenylmethoxyacetamide
CID 50848619
N-[5-(1-ethyl-5-methoxyindol-2-yl)-1H-pyrazol-3-yl]-3,5-dimethoxybenzamide
CID 53195961
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]-2-(3-methoxyphenyl)acetamide
CID 53196096
N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]acetamide
CID 53196135
5-bromo-N-[5-(1-ethyl-6-methoxyindol-2-yl)-1H-pyrazol-3-yl]pyridine-3-carboxamide
CID 53196151
N-(1-ethylbenzimidazol-2-yl)-2-(4-methoxyphenoxy)acetamide
CID 6494094
diethyl-[2-[2-[(2-phenoxyacetyl)amino]benzimidazol-1-yl]ethyl]azanium
CID 7423926
5-bromo-N-[5-(1-ethyl-4-methoxyindol-2-yl)-1H-pyrazol-3-yl]furan-2-carboxamide
CID 53196082
N-(5-phenyl-1H-pyrazol-3-yl)butanamide
CID 110868179

Frequently Asked Questions

What is the IUPAC name of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide?
The IUPAC name of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide (CID 53195937) is N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide is CCn1c(-c2cc(NC(=O)COc3ccccc3)n[nH]2)cc2ccccc21.
What is the InChIKey of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide?
The InChIKey is DWAMHZNBCVKEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O2/c1-2-25-18-11-7-6-8-15(18)12-19(25)17-13-20(24-23-17)22-21(26)14-27-16-9-4-3-5-10-16/h3-13H,2,14H2,1H3,(H2,22,23,24,26).
What are the key properties of N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide?
N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide has a molecular weight of 360.42 g/mol, XLogP of 4.07, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1-ethylindol-2-yl)-1H-pyrazol-3-yl]-2-phenoxyacetamide is sourced from PubChem (CID 53195937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).