N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide

C17H14N6O — CID 89451247

IUPACN-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(NC1CN=CC=N1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C17H14N6O/c24-17(21-15-10-19-6-7-20-15)16-13-8-11(3-4-14(13)22-23-16)12-2-1-5-18-9-12/h1-9,15H,10H2,(H,21,24)(H,22,23)
InChIKeyMSDKHJLYMWZVAG-UHFFFAOYSA-N
MW318.34 g/mol
LogP1.84
Rot. Bonds3

About N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide

N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide (PubChem CID 89451247) has the molecular formula C17H14N6O and a molecular weight of 318.34 g/mol. Its IUPAC name is N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide.

Molecular Properties

Compound NameN-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
PubChem CID89451247
Molecular FormulaC17H14N6O
Molecular Weight318.34 g/mol
Exact Mass318.12
IUPAC NameN-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide
SMILESO=C(NC1CN=CC=N1)c1n[nH]c2ccc(-c3cccnc3)cc12
InChIInChI=1S/C17H14N6O/c24-17(21-15-10-19-6-7-20-15)16-13-8-11(3-4-14(13)22-23-16)12-2-1-5-18-9-12/h1-9,15H,10H2,(H,21,24)(H,22,23)
InChIKeyMSDKHJLYMWZVAG-UHFFFAOYSA-N
XLogP1.84
TPSA95.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.34
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The IUPAC name of N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide (CID 89451247) is N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide.
What is the SMILES notation for N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The canonical SMILES for N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide is O=C(NC1CN=CC=N1)c1n[nH]c2ccc(-c3cccnc3)cc12.
What is the InChIKey of N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
The InChIKey is MSDKHJLYMWZVAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N6O/c24-17(21-15-10-19-6-7-20-15)16-13-8-11(3-4-14(13)22-23-16)12-2-1-5-18-9-12/h1-9,15H,10H2,(H,21,24)(H,22,23).
What are the key properties of N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide?
N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide has a molecular weight of 318.34 g/mol, XLogP of 1.84, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydropyrazin-2-yl)-5-pyridin-3-yl-1H-indazole-3-carboxamide is sourced from PubChem (CID 89451247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).