3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide

C19H21FN4O2 — CID 22260925

IUPAC3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide
SMILESCOc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)CCN(C)C
InChIInChI=1S/C19H21FN4O2/c1-24(2)8-7-18(25)21-16-10-14-15(11-17(16)26-3)22-23-19(14)12-5-4-6-13(20)9-12/h4-6,9-11H,7-8H2,1-3H3,(H,21,25)(H,22,23)
InChIKeyAQPHFMUZYMZLBB-UHFFFAOYSA-N
MW356.40 g/mol
LogP3.27
Rot. Bonds6

About 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide

3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide (PubChem CID 22260925) has the molecular formula C19H21FN4O2 and a molecular weight of 356.40 g/mol. Its IUPAC name is 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide
PubChem CID22260925
Molecular FormulaC19H21FN4O2
Molecular Weight356.40 g/mol
Exact Mass356.16
IUPAC Name3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide
SMILESCOc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)CCN(C)C
InChIInChI=1S/C19H21FN4O2/c1-24(2)8-7-18(25)21-16-10-14-15(11-17(16)26-3)22-23-19(14)12-5-4-6-13(20)9-12/h4-6,9-11H,7-8H2,1-3H3,(H,21,25)(H,22,23)
InChIKeyAQPHFMUZYMZLBB-UHFFFAOYSA-N
XLogP3.27
TPSA70.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.40
LogP ≤ 53.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(dimethylamino)-N-[6-fluoro-3-(3-fluorophenyl)-1H-indazol-5-yl]propanamide
CID 22260857
N-[2-(dimethylamino)ethyl]-3-(3-fluorophenyl)-6-hydroxy-1H-indazole-5-carboxamide
CID 135617784
N-[3-(3-fluorophenyl)-4-methoxy-1H-indazol-5-yl]-2-pyridin-3-ylacetamide
CID 23589897
methyl 3-(3-fluorophenyl)-1H-indazole-5-carboxylate
CID 22260721
2-[3-(3-fluorophenyl)-1H-indazol-5-yl]-N-[2-(3-methoxyphenyl)ethyl]acetamide
CID 22260918
3-(3-fluorophenyl)-N-[(3-methoxyphenyl)methyl]-1H-indazole-6-carboxamide
CID 22260682
3-(dimethylamino)-N-(1H-indazol-4-yl)propanamide
CID 110481555
N-[3-(3-fluorophenyl)-1H-pyrazolo[4,3-b]pyridin-5-yl]acetamide
CID 59797169
N-[[3-(3-fluorophenyl)-1H-indazol-5-yl]methyl]-3-methoxybenzamide
CID 22260912
[3-(3-fluorophenyl)-7-methoxy-1H-indazol-5-yl] hydrogen carbonate
CID 89134166
3-[(3-fluorophenyl)methyl-methylamino]-N-(2-methoxy-5-nitrophenyl)propanamide
CID 33478730
N-(5-fluoro-2-methoxyphenyl)-2-(3-fluorophenyl)acetamide
CID 110776591

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide?
The IUPAC name of 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide (CID 22260925) is 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide.
What is the SMILES notation for 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide?
The canonical SMILES for 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide is COc1cc2[nH]nc(-c3cccc(F)c3)c2cc1NC(=O)CCN(C)C.
What is the InChIKey of 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide?
The InChIKey is AQPHFMUZYMZLBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN4O2/c1-24(2)8-7-18(25)21-16-10-14-15(11-17(16)26-3)22-23-19(14)12-5-4-6-13(20)9-12/h4-6,9-11H,7-8H2,1-3H3,(H,21,25)(H,22,23).
What are the key properties of 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide?
3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide has a molecular weight of 356.40 g/mol, XLogP of 3.27, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-[3-(3-fluorophenyl)-6-methoxy-1H-indazol-5-yl]propanamide is sourced from PubChem (CID 22260925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).