5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide

C18H12FN5O — CID 156501595

IUPAC5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccncc1)c1n[nH]c2ccc(-c3cccnc3F)cc12
InChIInChI=1S/C18H12FN5O/c19-17-13(2-1-7-21-17)11-3-4-15-14(10-11)16(24-23-15)18(25)22-12-5-8-20-9-6-12/h1-10H,(H,23,24)(H,20,22,25)
InChIKeyVCYSNFMXGWBBEL-UHFFFAOYSA-N
MW333.33 g/mol
LogP3.41
Rot. Bonds3

About 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide

5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide (PubChem CID 156501595) has the molecular formula C18H12FN5O and a molecular weight of 333.33 g/mol. Its IUPAC name is 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide
PubChem CID156501595
Molecular FormulaC18H12FN5O
Molecular Weight333.33 g/mol
Exact Mass333.10
IUPAC Name5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccncc1)c1n[nH]c2ccc(-c3cccnc3F)cc12
InChIInChI=1S/C18H12FN5O/c19-17-13(2-1-7-21-17)11-3-4-15-14(10-11)16(24-23-15)18(25)22-12-5-8-20-9-6-12/h1-10H,(H,23,24)(H,20,22,25)
InChIKeyVCYSNFMXGWBBEL-UHFFFAOYSA-N
XLogP3.41
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.33
LogP ≤ 53.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-(2,3-difluorophenyl)-N-phenyl-1H-indazole-3-carboxamide
CID 118382349
5-(3-fluoro-2-methylphenyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide
CID 123828184
5-(2-fluoro-3-pyridinyl)-N-(oxolan-3-ylmethyl)-1H-indazole-3-carboxamide
CID 118382332
5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 118382000
N-(4-cyanophenyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89459269
5-(5-amino-3-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1H-indazole-3-carboxamide
CID 118382133
5-[4-(piperazine-1-carbonyl)phenyl]-N-pyridin-4-yl-1H-indazole-3-carboxamide
CID 156501650
N-[3-(4-fluorophenyl)-1H-indazol-5-yl]pyridine-4-carboxamide
CID 22479938
5-(2,3-difluorophenyl)-N-(6-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 118382138
5-(3-fluoro-2-methylphenyl)-N-(6-propan-2-yloxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 144928915
5-(2,3-difluorophenyl)-N-[6-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382251
N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89444854

Frequently Asked Questions

What is the IUPAC name of 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The IUPAC name of 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide (CID 156501595) is 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide is O=C(Nc1ccncc1)c1n[nH]c2ccc(-c3cccnc3F)cc12.
What is the InChIKey of 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide?
The InChIKey is VCYSNFMXGWBBEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12FN5O/c19-17-13(2-1-7-21-17)11-3-4-15-14(10-11)16(24-23-15)18(25)22-12-5-8-20-9-6-12/h1-10H,(H,23,24)(H,20,22,25).
What are the key properties of 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide?
5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide has a molecular weight of 333.33 g/mol, XLogP of 3.41, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide is sourced from PubChem (CID 156501595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).