N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide

C24H16FN5O2 — CID 89451062

IUPACN-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C24H16FN5O2/c25-17-10-18(13-27-12-17)28-24(31)23-21-9-15(6-7-22(21)29-30-23)16-8-20(14-26-11-16)32-19-4-2-1-3-5-19/h1-14H,(H,28,31)(H,29,30)
InChIKeyDPGJQTWTEQKJBM-UHFFFAOYSA-N
MW425.42 g/mol
LogP5.20
Rot. Bonds5

About N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide

N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 89451062) has the molecular formula C24H16FN5O2 and a molecular weight of 425.42 g/mol. Its IUPAC name is N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID89451062
Molecular FormulaC24H16FN5O2
Molecular Weight425.42 g/mol
Exact Mass425.13
IUPAC NameN-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C24H16FN5O2/c25-17-10-18(13-27-12-17)28-24(31)23-21-9-15(6-7-22(21)29-30-23)16-8-20(14-26-11-16)32-19-4-2-1-3-5-19/h1-14H,(H,28,31)(H,29,30)
InChIKeyDPGJQTWTEQKJBM-UHFFFAOYSA-N
XLogP5.20
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.42
LogP ≤ 55.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2s)-1-{[6-Furan-3-Yl-5-(3-Methyl-2h-Indazol-5-Yl)pyridin-3-Yl]oxy}-3-(1h-Indol-3-Yl)propan-2-Amine
CID 46225540
5-{5-[(2S)-2-amino-3-(4-fluoro-3-methylphenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16731501
5-{5-[(2S)-2-amino-3-(3-fluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16731988
5-{5-[(2S)-2-amino-3-(2,4-difluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16731989
5-{5-[(2S)-2-amino-3-(2,4,6-trifluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16731990
5-{5-[(2S)-2-amino-3-(2,3-difluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16732881
5-{5-[(2S)-2-amino-3-(2,6-difluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16732883
5-{5-[(2S)-2-amino-3-(2,3,4-trifluorophenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16733156
5-{5-[(2S)-2-amino-3-(3-fluoro-4-methylphenyl)propoxy]pyridin-3-yl}-3-methyl-1H-indazole
CID 16733278
(2S)-1-(1H-indol-3-yl)-3-(5-(3-methyl-1H-indazol-5-yl)-6-(2-methylfuran-3-yl)pyridin-3-yloxy)propan-2-amine
CID 46190874
Teplinovivint
CID 89451003
3-[(2S)-2-amino-3-phenylpropoxy]-5-[3-(furan-2-yl)-1H-pyrazolo[3,4-c]pyridin-5-yl]pyridine
CID 23647441

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide (CID 89451062) is N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide is O=C(Nc1cncc(F)c1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12.
What is the InChIKey of N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is DPGJQTWTEQKJBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN5O2/c25-17-10-18(13-27-12-17)28-24(31)23-21-9-15(6-7-22(21)29-30-23)16-8-20(14-26-11-16)32-19-4-2-1-3-5-19/h1-14H,(H,28,31)(H,29,30).
What are the key properties of N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide?
N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 425.42 g/mol, XLogP of 5.20, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-3-pyridinyl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 89451062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).