3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide

C22H24FN3O2 — CID 69064491

IUPAC3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)CCC3CCCC3)n[nH]c2c1
InChIInChI=1S/C22H24FN3O2/c1-28-20-10-8-16(23)13-18(20)15-7-9-17-19(12-15)25-26-22(17)24-21(27)11-6-14-4-2-3-5-14/h7-10,12-14H,2-6,11H2,1H3,(H2,24,25,26,27)
InChIKeyFASQQNWPADOLJY-UHFFFAOYSA-N
MW381.45 g/mol
LogP5.29
Rot. Bonds6

About 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide

3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide (PubChem CID 69064491) has the molecular formula C22H24FN3O2 and a molecular weight of 381.45 g/mol. Its IUPAC name is 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide
PubChem CID69064491
Molecular FormulaC22H24FN3O2
Molecular Weight381.45 g/mol
Exact Mass381.19
IUPAC Name3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide
SMILESCOc1ccc(F)cc1-c1ccc2c(NC(=O)CCC3CCCC3)n[nH]c2c1
InChIInChI=1S/C22H24FN3O2/c1-28-20-10-8-16(23)13-18(20)15-7-9-17-19(12-15)25-26-22(17)24-21(27)11-6-14-4-2-3-5-14/h7-10,12-14H,2-6,11H2,1H3,(H2,24,25,26,27)
InChIKeyFASQQNWPADOLJY-UHFFFAOYSA-N
XLogP5.29
TPSA67.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500381.45
LogP ≤ 55.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]amino]-2-oxoethyl] acetate
CID 69069713
N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenylmethoxyacetamide
CID 69064500
2-cyclopentyl-N-[6-(4-fluorophenyl)-1H-indazol-3-yl]acetamide
CID 69060428
2,3,6-trifluoro-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]benzamide
CID 69069464
N-[6-(2,5-difluorophenyl)-1H-indazol-3-yl]butanamide
CID 69065883
N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]furan-2-carboxamide
CID 69064766
2-cyclopentyl-N-[6-(3-fluorophenyl)-1H-indazol-3-yl]acetamide
CID 69060880
N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]-2-phenoxypropanamide
CID 69070154
[2-[[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]amino]-2-oxo-1-phenylethyl] acetate
CID 69070303
[2-[[6-(2,5-difluorophenyl)-1H-indazol-3-yl]amino]-2-oxoethyl] acetate
CID 69064232
N-[6-(2,5-dimethoxyphenyl)-1H-indazol-3-yl]-3-fluorobenzamide
CID 69064975
N-[6-(2-methoxy-5-propan-2-ylphenyl)-1H-indazol-3-yl]-3-phenylpropanamide
CID 69065644

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide?
The IUPAC name of 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide (CID 69064491) is 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide.
What is the SMILES notation for 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide?
The canonical SMILES for 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide is COc1ccc(F)cc1-c1ccc2c(NC(=O)CCC3CCCC3)n[nH]c2c1.
What is the InChIKey of 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide?
The InChIKey is FASQQNWPADOLJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FN3O2/c1-28-20-10-8-16(23)13-18(20)15-7-9-17-19(12-15)25-26-22(17)24-21(27)11-6-14-4-2-3-5-14/h7-10,12-14H,2-6,11H2,1H3,(H2,24,25,26,27).
What are the key properties of 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide?
3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide has a molecular weight of 381.45 g/mol, XLogP of 5.29, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-[6-(5-fluoro-2-methoxyphenyl)-1H-indazol-3-yl]propanamide is sourced from PubChem (CID 69064491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).