N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide

C21H17FN4O2 — CID 23589897

IUPACN-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide
SMILESCOc1c(NC(=O)Cc2cccnc2)ccc2[nH]nc(-c3cccc(F)c3)c12
InChIInChI=1S/C21H17FN4O2/c1-28-21-17(24-18(27)10-13-4-3-9-23-12-13)8-7-16-19(21)20(26-25-16)14-5-2-6-15(22)11-14/h2-9,11-12H,10H2,1H3,(H,24,27)(H,25,26)
InChIKeyYERDOHVVNDPAJO-UHFFFAOYSA-N
MW376.39 g/mol
LogP3.95
Rot. Bonds5

About N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide

N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide (PubChem CID 23589897) has the molecular formula C21H17FN4O2 and a molecular weight of 376.39 g/mol. Its IUPAC name is N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide.

Molecular Properties

Compound NameN-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide
PubChem CID23589897
Molecular FormulaC21H17FN4O2
Molecular Weight376.39 g/mol
Exact Mass376.13
IUPAC NameN-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide
SMILESCOc1c(NC(=O)Cc2cccnc2)ccc2[nH]nc(-c3cccc(F)c3)c12
InChIInChI=1S/C21H17FN4O2/c1-28-21-17(24-18(27)10-13-4-3-9-23-12-13)8-7-16-19(21)20(26-25-16)14-5-2-6-15(22)11-14/h2-9,11-12H,10H2,1H3,(H,24,27)(H,25,26)
InChIKeyYERDOHVVNDPAJO-UHFFFAOYSA-N
XLogP3.95
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.39
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3-(3-fluorophenyl)-1H-indazol-5-yl]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22260918
3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide
CID 22260925
methyl 3-(3-fluorophenyl)-1H-indazole-5-carboxylate
CID 22260721
N-[[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]pyridine-3-carboxamide
CID 22260966
3-(dimethylamino)-N-[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]propanamide
CID 22260857
N-[[3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-3-methoxybenzamide
CID 22260912
N-[3-(4-fluorophenyl)-5-[(pyridine-3-carbonylamino)carbamoyl]-1H-pyrazol-4-yl]-2-(3-methoxyphenyl)acetamide
CID 142699278
3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 22260682
2-(3-fluorophenyl)-N-(4-methyl-3-pyridinyl)acetamide
CID 154859403
N-[4-fluoro-2-(3-hydroxyprop-1-ynyl)phenyl]-2-pyridin-3-ylacetamide
CID 62688853
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591
N-[6-(5-fluoro-2-methoxyphenyl)pyrimidin-4-yl]-2-pyridin-3-ylacetamide
CID 59509147

Frequently Asked Questions

What is the IUPAC name of N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide?
The IUPAC name of N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide (CID 23589897) is N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide.
What is the SMILES notation for N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide?
The canonical SMILES for N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide is COc1c(NC(=O)Cc2cccnc2)ccc2[nH]nc(-c3cccc(F)c3)c12.
What is the InChIKey of N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide?
The InChIKey is YERDOHVVNDPAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17FN4O2/c1-28-21-17(24-18(27)10-13-4-3-9-23-12-13)8-7-16-19(21)20(26-25-16)14-5-2-6-15(22)11-14/h2-9,11-12H,10H2,1H3,(H,24,27)(H,25,26).
What are the key properties of N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide?
N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide has a molecular weight of 376.39 g/mol, XLogP of 3.95, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide is sourced from PubChem (CID 23589897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).