N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide

C18H18F2N4O3 — CID 155438456

IUPACN-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide
SMILESCOCCn1cc2cc(C(=O)Nc3cccc(C(F)F)n3)c(OC)cc2n1
InChIInChI=1S/C18H18F2N4O3/c1-26-7-6-24-10-11-8-12(15(27-2)9-14(11)23-24)18(25)22-16-5-3-4-13(21-16)17(19)20/h3-5,8-10,17H,6-7H2,1-2H3,(H,21,22,25)
InChIKeyHQJDBZTWSZPUES-UHFFFAOYSA-N
MW376.36 g/mol
LogP3.28
Rot. Bonds7

About N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide

N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide (PubChem CID 155438456) has the molecular formula C18H18F2N4O3 and a molecular weight of 376.36 g/mol. Its IUPAC name is N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide.

Molecular Properties

Compound NameN-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide
PubChem CID155438456
Molecular FormulaC18H18F2N4O3
Molecular Weight376.36 g/mol
Exact Mass376.13
IUPAC NameN-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide
SMILESCOCCn1cc2cc(C(=O)Nc3cccc(C(F)F)n3)c(OC)cc2n1
InChIInChI=1S/C18H18F2N4O3/c1-26-7-6-24-10-11-8-12(15(27-2)9-14(11)23-24)18(25)22-16-5-3-4-13(21-16)17(19)20/h3-5,8-10,17H,6-7H2,1-2H3,(H,21,22,25)
InChIKeyHQJDBZTWSZPUES-UHFFFAOYSA-N
XLogP3.28
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.36
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide?
The IUPAC name of N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide (CID 155438456) is N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide.
What is the SMILES notation for N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide?
The canonical SMILES for N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide is COCCn1cc2cc(C(=O)Nc3cccc(C(F)F)n3)c(OC)cc2n1.
What is the InChIKey of N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide?
The InChIKey is HQJDBZTWSZPUES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N4O3/c1-26-7-6-24-10-11-8-12(15(27-2)9-14(11)23-24)18(25)22-16-5-3-4-13(21-16)17(19)20/h3-5,8-10,17H,6-7H2,1-2H3,(H,21,22,25).
What are the key properties of N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide?
N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide has a molecular weight of 376.36 g/mol, XLogP of 3.28, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(2-methoxyethyl)indazole-5-carboxamide is sourced from PubChem (CID 155438456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).