N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide

C20H19FN6O2 — CID 46996916

IUPACN-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide
SMILESCCn1ncc(NC(=O)Cn2nc(-c3cc(F)ccc3OC)c3ccccc32)n1
InChIInChI=1S/C20H19FN6O2/c1-3-27-22-11-18(24-27)23-19(28)12-26-16-7-5-4-6-14(16)20(25-26)15-10-13(21)8-9-17(15)29-2/h4-11H,3,12H2,1-2H3,(H,23,24,28)
InChIKeyOGAMMWFTPFAHSI-UHFFFAOYSA-N
MW394.41 g/mol
LogP3.10
Rot. Bonds6

About N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide

N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide (PubChem CID 46996916) has the molecular formula C20H19FN6O2 and a molecular weight of 394.41 g/mol. Its IUPAC name is N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide.

Molecular Properties

Compound NameN-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide
PubChem CID46996916
Molecular FormulaC20H19FN6O2
Molecular Weight394.41 g/mol
Exact Mass394.16
IUPAC NameN-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide
SMILESCCn1ncc(NC(=O)Cn2nc(-c3cc(F)ccc3OC)c3ccccc32)n1
InChIInChI=1S/C20H19FN6O2/c1-3-27-22-11-18(24-27)23-19(28)12-26-16-7-5-4-6-14(16)20(25-26)15-10-13(21)8-9-17(15)29-2/h4-11H,3,12H2,1-2H3,(H,23,24,28)
InChIKeyOGAMMWFTPFAHSI-UHFFFAOYSA-N
XLogP3.10
TPSA86.86 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.41
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(2-ethyltriazol-4-yl)-2-[5-(2-methylphenyl)indazol-1-yl]acetamide
CID 46982211
2-(3,5-dimethylpyrazol-1-yl)-N-(2-ethyltriazol-4-yl)acetamide
CID 46990903
2-[3-(1,3-benzodioxol-5-yl)indazol-1-yl]-N-(2-methyltriazol-4-yl)acetamide
CID 46983709
N-[(5-bromo-2-methoxyphenyl)methyl]-2-(3-phenylindazol-1-yl)acetamide
CID 20877615
N-(5-bromo-2-methoxyphenyl)-2-(4-oxocinnolin-1-yl)acetamide
CID 55905258
N-[(4-fluorophenyl)methyl]-2-(3-phenylindazol-1-yl)acetamide
CID 3441862
2-[5-[(3-fluorophenyl)methyl]-3-oxopyrazolo[4,3-c]quinolin-2-yl]-N-(4-methoxyphenyl)acetamide
CID 20918697
2-(1-ethylindazol-5-yl)-N-[2-[(4-fluoro-3-methoxyphenyl)methyl]triazol-4-yl]acetamide
CID 118961979
2-(1,3-dioxoisoindol-2-yl)-N-(5-fluoro-2-methoxyphenyl)acetamide
CID 110776571
methyl 1-[2-[(2-ethyltriazol-4-yl)amino]-2-oxoethyl]pyrazole-3-carboxylate
CID 46988642
ethyl N-[2-[2-[2-methoxy-5-(trifluoromethyl)anilino]-2-oxoethyl]triazol-4-yl]carbamate
CID 112523331
2-[4-(3-acetylphenyl)-3,5-dimethylpyrazol-1-yl]-N-(2-ethyltriazol-4-yl)acetamide
CID 46983725

Frequently Asked Questions

What is the IUPAC name of N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide?
The IUPAC name of N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide (CID 46996916) is N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide.
What is the SMILES notation for N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide?
The canonical SMILES for N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide is CCn1ncc(NC(=O)Cn2nc(-c3cc(F)ccc3OC)c3ccccc32)n1.
What is the InChIKey of N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide?
The InChIKey is OGAMMWFTPFAHSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN6O2/c1-3-27-22-11-18(24-27)23-19(28)12-26-16-7-5-4-6-14(16)20(25-26)15-10-13(21)8-9-17(15)29-2/h4-11H,3,12H2,1-2H3,(H,23,24,28).
What are the key properties of N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide?
N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide has a molecular weight of 394.41 g/mol, XLogP of 3.10, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethyltriazol-4-yl)-2-[3-(5-fluoro-2-methoxyphenyl)indazol-1-yl]acetamide is sourced from PubChem (CID 46996916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).