5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide

C30H21N5O2 — CID 89450561

IUPAC5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)nc1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C30H21N5O2/c36-30(33-23-12-14-27(32-18-23)20-7-3-1-4-8-20)29-26-16-21(11-13-28(26)34-35-29)22-15-25(19-31-17-22)37-24-9-5-2-6-10-24/h1-19H,(H,33,36)(H,34,35)
InChIKeyLMKXOESWPWMIGU-UHFFFAOYSA-N
MW483.53 g/mol
LogP6.73
Rot. Bonds6

About 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide

5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 89450561) has the molecular formula C30H21N5O2 and a molecular weight of 483.53 g/mol. Its IUPAC name is 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID89450561
Molecular FormulaC30H21N5O2
Molecular Weight483.53 g/mol
Exact Mass483.17
IUPAC Name5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide
SMILESO=C(Nc1ccc(-c2ccccc2)nc1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12
InChIInChI=1S/C30H21N5O2/c36-30(33-23-12-14-27(32-18-23)20-7-3-1-4-8-20)29-26-16-21(11-13-28(26)34-35-29)22-15-25(19-31-17-22)37-24-9-5-2-6-10-24/h1-19H,(H,33,36)(H,34,35)
InChIKeyLMKXOESWPWMIGU-UHFFFAOYSA-N
XLogP6.73
TPSA92.79 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500483.53
LogP ≤ 56.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[6-(dimethylamino)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 89450552
N-(1,3-benzodioxol-5-yl)-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 89451156
5-(5-phenoxy-3-pyridinyl)-N-[5-(trifluoromethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381665
ethane;N-(6-phenyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 144555502
5-[5-[(4-methylpiperidin-1-yl)methyl]-3-pyridinyl]-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 118382472
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-[6-(3-ethylpentanoyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-ethylpentanoyl)-3-pyridinyl]-5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(3-ethylpentanoyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-(3-ethylpentanoyl)-3-pyridinyl]-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 158393432
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 159944208
N-(6-propan-2-yloxy-3-pyridinyl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 118382344
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-(6-propan-2-ylsulfonyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(morpholin-4-ylmethyl)-3-pyridinyl]-N-(6-propan-2-ylsulfonyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-(5-phenoxy-3-pyridinyl)-N-(6-propan-2-ylsulfonyl-3-pyridinyl)-1H-indazole-3-carboxamide;5-[5-(piperidin-1-ylmethyl)-3-pyridinyl]-N-(6-propan-2-ylsulfonyl-3-pyridinyl)-1H-indazole-3-carboxamide;N-(6-propan-2-ylsulfonyl-3-pyridinyl)-5-[5-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 159293584
N-[2-(dimethylamino)-2,3-dihydropyridin-5-yl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 123416616
N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89444854
5-[5-(azetidin-1-ylmethyl)-3-pyridinyl]-N-[6-(azetidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(azetidin-1-ylmethyl)-3-pyridinyl]-5-[5-(cyclopropanecarbonylamino)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(azetidin-1-ylmethyl)-3-pyridinyl]-5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-1H-indazole-3-carboxamide;N-[6-(azetidin-1-ylmethyl)-3-pyridinyl]-5-(5-phenoxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 158088813

Frequently Asked Questions

What is the IUPAC name of 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide (CID 89450561) is 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide is O=C(Nc1ccc(-c2ccccc2)nc1)c1n[nH]c2ccc(-c3cncc(Oc4ccccc4)c3)cc12.
What is the InChIKey of 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is LMKXOESWPWMIGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H21N5O2/c36-30(33-23-12-14-27(32-18-23)20-7-3-1-4-8-20)29-26-16-21(11-13-28(26)34-35-29)22-15-25(19-31-17-22)37-24-9-5-2-6-10-24/h1-19H,(H,33,36)(H,34,35).
What are the key properties of 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide?
5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 483.53 g/mol, XLogP of 6.73, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-phenoxy-3-pyridinyl)-N-(6-phenyl-3-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 89450561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).