2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide

C23H20ClN3O3 — CID 69069808

IUPAC2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide
SMILESCCOc1ccccc1-c1ccc2c(NC(=O)COc3ccc(Cl)cc3)n[nH]c2c1
InChIInChI=1S/C23H20ClN3O3/c1-2-29-21-6-4-3-5-18(21)15-7-12-19-20(13-15)26-27-23(19)25-22(28)14-30-17-10-8-16(24)9-11-17/h3-13H,2,14H2,1H3,(H2,25,26,27,28)
InChIKeyFCAXWQZLSKPSKC-UHFFFAOYSA-N
MW421.88 g/mol
LogP5.30
Rot. Bonds7

About 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide

2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide (PubChem CID 69069808) has the molecular formula C23H20ClN3O3 and a molecular weight of 421.88 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide
PubChem CID69069808
Molecular FormulaC23H20ClN3O3
Molecular Weight421.88 g/mol
Exact Mass421.12
IUPAC Name2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide
SMILESCCOc1ccccc1-c1ccc2c(NC(=O)COc3ccc(Cl)cc3)n[nH]c2c1
InChIInChI=1S/C23H20ClN3O3/c1-2-29-21-6-4-3-5-18(21)15-7-12-19-20(13-15)26-27-23(19)25-22(28)14-30-17-10-8-16(24)9-11-17/h3-13H,2,14H2,1H3,(H2,25,26,27,28)
InChIKeyFCAXWQZLSKPSKC-UHFFFAOYSA-N
XLogP5.30
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500421.88
LogP ≤ 55.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]cyclopentanecarboxamide
CID 69065075
[2-[[6-(2-ethoxyphenyl)-1H-indazol-3-yl]amino]-2-oxo-1-phenylethyl] acetate
CID 69069627
N-[6-(4-chlorophenyl)-1H-indazol-3-yl]butanamide
CID 22319587
N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]butanamide
CID 69065883
[2-[[6-(2,5-difluorophenyl)-1H-indazol-3-yl]amino]-2-oxoethyl] acetate
CID 69064232
2-(4-chlorophenoxy)-N-[5-methyl-4-(3,4,5-trimethoxyphenyl)-1H-pyrazol-3-yl]acetamide
CID 53197969
2,4-dichloro-N-[6-(3-ethoxyphenyl)-1H-indazol-3-yl]benzamide
CID 69061802
[2-[[6-(3-chlorophenyl)-1H-indazol-3-yl]amino]-2-oxoethyl] acetate
CID 69060604
1-[6-(2-methoxyphenyl)-1H-indazol-3-yl]-3-(3-phenylpropyl)urea
CID 69061205
3,5-dichloro-N-[6-(2-methylphenyl)-1H-indazol-3-yl]benzamide
CID 69060060
benzene;bis(2-(4-chlorophenoxy)-N-[4-(3,4-dimethoxyphenyl)-1,2,5-oxadiazol-3-yl]acetamide)
CID 175653131
N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide
CID 69064500

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide (CID 69069808) is 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide is CCOc1ccccc1-c1ccc2c(NC(=O)COc3ccc(Cl)cc3)n[nH]c2c1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide?
The InChIKey is FCAXWQZLSKPSKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClN3O3/c1-2-29-21-6-4-3-5-18(21)15-7-12-19-20(13-15)26-27-23(19)25-22(28)14-30-17-10-8-16(24)9-11-17/h3-13H,2,14H2,1H3,(H2,25,26,27,28).
What are the key properties of 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide?
2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide has a molecular weight of 421.88 g/mol, XLogP of 5.30, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-[6-(2-ethoxyphenyl)-1H-indazol-3-yl]acetamide is sourced from PubChem (CID 69069808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).