2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide

C19H25FN4O — CID 24968466

IUPAC2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide
SMILESNC(=O)c1cc(F)cc2cn(C3CCCN(C4CCCCC4)C3)nc12
InChIInChI=1S/C19H25FN4O/c20-14-9-13-11-24(22-18(13)17(10-14)19(21)25)16-7-4-8-23(12-16)15-5-2-1-3-6-15/h9-11,15-16H,1-8,12H2,(H2,21,25)
InChIKeyFCRGWRAVKLHBRK-UHFFFAOYSA-N
MW344.43 g/mol
LogP3.24
Rot. Bonds3

About 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide

2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide (PubChem CID 24968466) has the molecular formula C19H25FN4O and a molecular weight of 344.43 g/mol. Its IUPAC name is 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide.

Molecular Properties

Compound Name2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide
PubChem CID24968466
Molecular FormulaC19H25FN4O
Molecular Weight344.43 g/mol
Exact Mass344.20
IUPAC Name2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide
SMILESNC(=O)c1cc(F)cc2cn(C3CCCN(C4CCCCC4)C3)nc12
InChIInChI=1S/C19H25FN4O/c20-14-9-13-11-24(22-18(13)17(10-14)19(21)25)16-7-4-8-23(12-16)15-5-2-1-3-6-15/h9-11,15-16H,1-8,12H2,(H2,21,25)
InChIKeyFCRGWRAVKLHBRK-UHFFFAOYSA-N
XLogP3.24
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.43
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide?
The IUPAC name of 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide (CID 24968466) is 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide.
What is the SMILES notation for 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide?
The canonical SMILES for 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide is NC(=O)c1cc(F)cc2cn(C3CCCN(C4CCCCC4)C3)nc12.
What is the InChIKey of 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide?
The InChIKey is FCRGWRAVKLHBRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25FN4O/c20-14-9-13-11-24(22-18(13)17(10-14)19(21)25)16-7-4-8-23(12-16)15-5-2-1-3-6-15/h9-11,15-16H,1-8,12H2,(H2,21,25).
What are the key properties of 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide?
2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide has a molecular weight of 344.43 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-cyclohexylpiperidin-3-yl)-5-fluoroindazole-7-carboxamide is sourced from PubChem (CID 24968466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).