6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide

C19H20FN5O2 — CID 71239722

IUPAC6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide
SMILESCn1c2cc(F)cc(C(N)=O)c2c(=O)n1C1CCN(c2cccnc2)CC1
InChIInChI=1S/C19H20FN5O2/c1-23-16-10-12(20)9-15(18(21)26)17(16)19(27)25(23)13-4-7-24(8-5-13)14-3-2-6-22-11-14/h2-3,6,9-11,13H,4-5,7-8H2,1H3,(H2,21,26)
InChIKeyVNNYGCPDAUKGHU-UHFFFAOYSA-N
MW369.40 g/mol
LogP1.81
Rot. Bonds3

About 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide

6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide (PubChem CID 71239722) has the molecular formula C19H20FN5O2 and a molecular weight of 369.40 g/mol. Its IUPAC name is 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide.

Molecular Properties

Compound Name6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide
PubChem CID71239722
Molecular FormulaC19H20FN5O2
Molecular Weight369.40 g/mol
Exact Mass369.16
IUPAC Name6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide
SMILESCn1c2cc(F)cc(C(N)=O)c2c(=O)n1C1CCN(c2cccnc2)CC1
InChIInChI=1S/C19H20FN5O2/c1-23-16-10-12(20)9-15(18(21)26)17(16)19(27)25(23)13-4-7-24(8-5-13)14-3-2-6-22-11-14/h2-3,6,9-11,13H,4-5,7-8H2,1H3,(H2,21,26)
InChIKeyVNNYGCPDAUKGHU-UHFFFAOYSA-N
XLogP1.81
TPSA86.15 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-3-oxo-2-(1-pyridin-4-ylpiperidin-4-yl)indazole-4-carboxamide
CID 71240151
1-pyridin-3-ylpyrrolidine-3-carboxamide;dihydrochloride
CID 175830226
4-(3,5-difluorophenyl)aniline;3-[4-(3,5-difluorophenyl)phenyl]-1-methyl-1-(1-pyridin-3-ylpiperidin-4-yl)urea
CID 158600699
5-fluoro-N,N-dimethyl-1'-(1-pyridin-3-ylpiperidin-4-yl)spiro[2H-indole-3,4'-piperidine]-1-carboxamide
CID 23651582
1-pyridin-3-ylpyrrolidine-3-carboxylic acid
CID 51063831
(1-pyridin-3-ylpiperidin-4-yl) N,N-di(propan-2-yl)carbamate
CID 146464348
tert-butyl 1-pyridin-3-ylpiperidine-4-carboxylate
CID 21334263
5-(4-fluorophenyl)-4-oxo-1-pyridin-3-ylpyridine-3-carboxamide
CID 175770992
ethane;1-methyl-4-pyridin-3-ylpiperazine
CID 144911309
N-methyl-N-(1-pyridin-3-ylpyrrolidin-3-yl)prop-2-enamide
CID 170551154
(1-pyridin-3-ylpiperidin-4-yl) hypochlorite
CID 174467060
1-pyridin-3-ylpiperidine-4-carbonitrile
CID 71721220

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide?
The IUPAC name of 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide (CID 71239722) is 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide.
What is the SMILES notation for 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide?
The canonical SMILES for 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide is Cn1c2cc(F)cc(C(N)=O)c2c(=O)n1C1CCN(c2cccnc2)CC1.
What is the InChIKey of 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide?
The InChIKey is VNNYGCPDAUKGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20FN5O2/c1-23-16-10-12(20)9-15(18(21)26)17(16)19(27)25(23)13-4-7-24(8-5-13)14-3-2-6-22-11-14/h2-3,6,9-11,13H,4-5,7-8H2,1H3,(H2,21,26).
What are the key properties of 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide?
6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide has a molecular weight of 369.40 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1-methyl-3-oxo-2-(1-pyridin-3-ylpiperidin-4-yl)indazole-4-carboxamide is sourced from PubChem (CID 71239722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).