N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide

C30H20FN5O2 — CID 137108309

IUPACN-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2F)nc1)c1[nH]nc2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C30H20FN5O2/c31-26-9-5-4-8-24(26)27-13-11-21(17-33-27)34-30(37)29-25-15-19(10-12-28(25)35-36-29)20-14-23(18-32-16-20)38-22-6-2-1-3-7-22/h1-18H,(H,34,37)(H,35,36)
InChIKeyBOXSLSCDPUMULM-UHFFFAOYSA-N
MW501.52 g/mol
LogP6.87
Rot. Bonds6

About N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide

N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide (PubChem CID 137108309) has the molecular formula C30H20FN5O2 and a molecular weight of 501.52 g/mol. Its IUPAC name is N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide
PubChem CID137108309
Molecular FormulaC30H20FN5O2
Molecular Weight501.52 g/mol
Exact Mass501.16
IUPAC NameN-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2F)nc1)c1[nH]nc2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C30H20FN5O2/c31-26-9-5-4-8-24(26)27-13-11-21(17-33-27)34-30(37)29-25-15-19(10-12-28(25)35-36-29)20-14-23(18-32-16-20)38-22-6-2-1-3-7-22/h1-18H,(H,34,37)(H,35,36)
InChIKeyBOXSLSCDPUMULM-UHFFFAOYSA-N
XLogP6.87
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.52
LogP ≤ 56.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide with MolForge

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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
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
5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-(6-propan-2-yloxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 118381715
(S)-1-(5-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46190875
(S)-1-(6-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46226075
(S)-1-(7-fluoro-1H-indol-3-yl)-3-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)propan-2-amine
CID 46226076
1'-(7-methyl-1H-indazole-5-carbonyl)-6-(1-methylpyrazol-4-yl)spiro[3H-pyrano[2,3-c]pyridine-2,4'-piperidine]-4-one
CID 46884847
(S)-1-(6-(furan-3-yl)-5-(3-methyl-1H-indazol-5-yl)pyridin-3-yloxy)-3-phenylpropan-2-amine
CID 11495551
5-methyl-N-(6-(2-methylpyridin-3-yloxy)pyridin-3-yl)-1H-indole-3-carboxamide
CID 44251387

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide?
The IUPAC name of N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide (CID 137108309) is N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide.
What is the SMILES notation for N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide?
The canonical SMILES for N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide is O=C(Nc1ccc(-c2ccccc2F)nc1)c1[nH]nc2ccc(-c3cncc(Oc4ccccc4)c3)cc12.
What is the InChIKey of N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide?
The InChIKey is BOXSLSCDPUMULM-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20FN5O2/c31-26-9-5-4-8-24(26)27-13-11-21(17-33-27)34-30(37)29-25-15-19(10-12-28(25)35-36-29)20-14-23(18-32-16-20)38-22-6-2-1-3-7-22/h1-18H,(H,34,37)(H,35,36).
What are the key properties of N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide?
N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide has a molecular weight of 501.52 g/mol, XLogP of 6.87, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2-fluorophenyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-2H-indazole-3-carboxamide is sourced from PubChem (CID 137108309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).