4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide

C19H19FN4O — CID 58926850

IUPAC4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CCC(c2ccccc2F)CC1
InChIInChI=1S/C19H19FN4O/c20-16-7-3-1-5-14(16)13-9-11-24(12-10-13)19(25)21-18-15-6-2-4-8-17(15)22-23-18/h1-8,13H,9-12H2,(H2,21,22,23,25)
InChIKeyMIUBEHSTHLIUMQ-UHFFFAOYSA-N
MW338.39 g/mol
LogP4.11
Rot. Bonds2

About 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide

4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide (PubChem CID 58926850) has the molecular formula C19H19FN4O and a molecular weight of 338.39 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide.

Molecular Properties

Compound Name4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide
PubChem CID58926850
Molecular FormulaC19H19FN4O
Molecular Weight338.39 g/mol
Exact Mass338.15
IUPAC Name4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide
SMILESO=C(Nc1n[nH]c2ccccc12)N1CCC(c2ccccc2F)CC1
InChIInChI=1S/C19H19FN4O/c20-16-7-3-1-5-14(16)13-9-11-24(12-10-13)19(25)21-18-15-6-2-4-8-17(15)22-23-18/h1-8,13H,9-12H2,(H2,21,22,23,25)
InChIKeyMIUBEHSTHLIUMQ-UHFFFAOYSA-N
XLogP4.11
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.39
LogP ≤ 54.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The IUPAC name of 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide (CID 58926850) is 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide.
What is the SMILES notation for 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The canonical SMILES for 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide is O=C(Nc1n[nH]c2ccccc12)N1CCC(c2ccccc2F)CC1.
What is the InChIKey of 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
The InChIKey is MIUBEHSTHLIUMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19FN4O/c20-16-7-3-1-5-14(16)13-9-11-24(12-10-13)19(25)21-18-15-6-2-4-8-17(15)22-23-18/h1-8,13H,9-12H2,(H2,21,22,23,25).
What are the key properties of 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide?
4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide has a molecular weight of 338.39 g/mol, XLogP of 4.11, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-N-(1H-indazol-3-yl)piperidine-1-carboxamide is sourced from PubChem (CID 58926850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).