5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide

C19H13F2N5O — CID 118382000

IUPAC5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
SMILESCc1ncc(NC(=O)c2n[nH]c3ccc(-c4cccc(F)c4F)cc23)cn1
InChIInChI=1S/C19H13F2N5O/c1-10-22-8-12(9-23-10)24-19(27)18-14-7-11(5-6-16(14)25-26-18)13-3-2-4-15(20)17(13)21/h2-9H,1H3,(H,24,27)(H,25,26)
InChIKeyRMGIYEVSHMRXMI-UHFFFAOYSA-N
MW365.34 g/mol
LogP3.86
Rot. Bonds3

About 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide

5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide (PubChem CID 118382000) has the molecular formula C19H13F2N5O and a molecular weight of 365.34 g/mol. Its IUPAC name is 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
PubChem CID118382000
Molecular FormulaC19H13F2N5O
Molecular Weight365.34 g/mol
Exact Mass365.11
IUPAC Name5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
SMILESCc1ncc(NC(=O)c2n[nH]c3ccc(-c4cccc(F)c4F)cc23)cn1
InChIInChI=1S/C19H13F2N5O/c1-10-22-8-12(9-23-10)24-19(27)18-14-7-11(5-6-16(14)25-26-18)13-3-2-4-15(20)17(13)21/h2-9H,1H3,(H,24,27)(H,25,26)
InChIKeyRMGIYEVSHMRXMI-UHFFFAOYSA-N
XLogP3.86
TPSA83.56 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.34
LogP ≤ 53.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2,3-difluorophenyl)-N-phenyl-1H-indazole-3-carboxamide
CID 118382349
5-(2,3-difluorophenyl)-N-(6-piperidin-1-yl-3-pyridinyl)-1H-indazole-3-carboxamide
CID 118382138
5-(2,3-difluorophenyl)-N-[6-(pyrrolidin-1-ylmethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382251
N-[6-(3,3-difluoroazetidin-1-yl)-3-pyridinyl]-5-(2,3-difluorophenyl)-1H-indazole-3-carboxamide
CID 118382069
5-(2,3-difluorophenyl)-N-[6-(3-fluorophenoxy)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381811
5-(3-fluoro-2-methylphenyl)-N-pyridin-3-yl-1H-indazole-3-carboxamide
CID 123828184
5-(3-fluoro-2-methylphenyl)-N-(6-propan-2-yloxy-3-pyridinyl)-1H-indazole-3-carboxamide
CID 144928915
N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 154796255
1-[5-(2,3-difluorophenyl)-1H-indazol-3-yl]-2-(6-phenyl-3-pyridinyl)propan-1-one
CID 123472402
5-(2-fluoro-3-pyridinyl)-N-pyridin-4-yl-1H-indazole-3-carboxamide
CID 156501595
5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 89459134
5-(3-fluoro-2-methylphenyl)-1H-indazole-3-carboxamide
CID 123518046

Frequently Asked Questions

What is the IUPAC name of 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide (CID 118382000) is 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide is Cc1ncc(NC(=O)c2n[nH]c3ccc(-c4cccc(F)c4F)cc23)cn1.
What is the InChIKey of 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide?
The InChIKey is RMGIYEVSHMRXMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13F2N5O/c1-10-22-8-12(9-23-10)24-19(27)18-14-7-11(5-6-16(14)25-26-18)13-3-2-4-15(20)17(13)21/h2-9H,1H3,(H,24,27)(H,25,26).
What are the key properties of 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide?
5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide has a molecular weight of 365.34 g/mol, XLogP of 3.86, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,3-difluorophenyl)-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 118382000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).