5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide

C18H12F2N6O — CID 118382179

IUPAC5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide
SMILESNc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ncc(F)cc4F)c3c2)c1
InChIInChI=1S/C18H12F2N6O/c19-11-5-14(20)17(23-7-11)24-18(27)16-13-4-9(1-2-15(13)25-26-16)10-3-12(21)8-22-6-10/h1-8H,21H2,(H,25,26)(H,23,24,27)
InChIKeyBKVLGKGGQDTPKS-UHFFFAOYSA-N
MW366.33 g/mol
LogP3.13
Rot. Bonds3

About 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide

5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide (PubChem CID 118382179) has the molecular formula C18H12F2N6O and a molecular weight of 366.33 g/mol. Its IUPAC name is 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide.

Molecular Properties

Compound Name5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide
PubChem CID118382179
Molecular FormulaC18H12F2N6O
Molecular Weight366.33 g/mol
Exact Mass366.10
IUPAC Name5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide
SMILESNc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ncc(F)cc4F)c3c2)c1
InChIInChI=1S/C18H12F2N6O/c19-11-5-14(20)17(23-7-11)24-18(27)16-13-4-9(1-2-15(13)25-26-16)10-3-12(21)8-22-6-10/h1-8H,21H2,(H,25,26)(H,23,24,27)
InChIKeyBKVLGKGGQDTPKS-UHFFFAOYSA-N
XLogP3.13
TPSA109.58 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.33
LogP ≤ 53.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-(5-amino-3-pyridinyl)-N-(5-fluoro-2-pyridinyl)-1H-indazole-3-carboxamide
CID 118381935
N-(3,5-difluoro-2-pyridinyl)-5-[5-[(4-methylpiperidin-1-yl)methyl]-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118381576
5-(5-amino-3-pyridinyl)-N-[2-(trifluoromethyl)-4-pyridinyl]-1H-indazole-3-carboxamide
CID 118382133
5-(5-amino-3-pyridinyl)-N-[5-(trifluoromethyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 118382058
N-[5-(5-amino-3-pyridinyl)-1H-indazol-3-yl]benzamide
CID 171349998
5-(5-amino-3-pyridinyl)-N-(3-benzylphenyl)-1H-indazole-3-carboxamide
CID 89459064
5-(5-amino-3-pyridinyl)-N-[6-(3-ethylpentanoyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 146905101
5-(5-amino-3-pyridinyl)-N-[6-(pentan-3-ylcarbamoyl)-3-pyridinyl]-1H-indazole-3-carboxamide
CID 89450628
5-(5-amino-3-pyridinyl)-N-(1-tert-butylpiperidin-4-yl)-1H-indazole-3-carboxamide
CID 118382151
5-[5-[(4,4-difluoropiperidin-1-yl)methyl]-3-pyridinyl]-N-(5-fluoro-3-pyridinyl)-1H-indazole-3-carboxamide
CID 89451248
5-[5-(dimethylcarbamoylamino)-3-pyridinyl]-N-(2-methylpyrimidin-5-yl)-1H-indazole-3-carboxamide
CID 89459134
N-[6-(3-fluorophenoxy)-3-pyridinyl]-5-pyridin-3-yl-1H-indazole-3-carboxamide
CID 89444854

Frequently Asked Questions

What is the IUPAC name of 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide?
The IUPAC name of 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide (CID 118382179) is 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide.
What is the SMILES notation for 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide?
The canonical SMILES for 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide is Nc1cncc(-c2ccc3[nH]nc(C(=O)Nc4ncc(F)cc4F)c3c2)c1.
What is the InChIKey of 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide?
The InChIKey is BKVLGKGGQDTPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12F2N6O/c19-11-5-14(20)17(23-7-11)24-18(27)16-13-4-9(1-2-15(13)25-26-16)10-3-12(21)8-22-6-10/h1-8H,21H2,(H,25,26)(H,23,24,27).
What are the key properties of 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide?
5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide has a molecular weight of 366.33 g/mol, XLogP of 3.13, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-amino-3-pyridinyl)-N-(3,5-difluoro-2-pyridinyl)-1H-indazole-3-carboxamide is sourced from PubChem (CID 118382179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).