5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide

C19H16N6O — CID 59023830

IUPAC5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide
SMILESNc1cc(Nc2cc(C(=O)Nc3ccccc3)c3[nH]ncc3c2)ccn1
InChIInChI=1S/C19H16N6O/c20-17-10-14(6-7-21-17)23-15-8-12-11-22-25-18(12)16(9-15)19(26)24-13-4-2-1-3-5-13/h1-11H,(H,22,25)(H,24,26)(H3,20,21,23)
InChIKeyJGWNDRGBWUYYON-UHFFFAOYSA-N
MW344.38 g/mol
LogP3.54
Rot. Bonds4

About 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide

5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide (PubChem CID 59023830) has the molecular formula C19H16N6O and a molecular weight of 344.38 g/mol. Its IUPAC name is 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide.

Molecular Properties

Compound Name5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide
PubChem CID59023830
Molecular FormulaC19H16N6O
Molecular Weight344.38 g/mol
Exact Mass344.14
IUPAC Name5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide
SMILESNc1cc(Nc2cc(C(=O)Nc3ccccc3)c3[nH]ncc3c2)ccn1
InChIInChI=1S/C19H16N6O/c20-17-10-14(6-7-21-17)23-15-8-12-11-22-25-18(12)16(9-15)19(26)24-13-4-2-1-3-5-13/h1-11H,(H,22,25)(H,24,26)(H3,20,21,23)
InChIKeyJGWNDRGBWUYYON-UHFFFAOYSA-N
XLogP3.54
TPSA108.72 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.38
LogP ≤ 53.54
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide?
The IUPAC name of 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide (CID 59023830) is 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide.
What is the SMILES notation for 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide?
The canonical SMILES for 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide is Nc1cc(Nc2cc(C(=O)Nc3ccccc3)c3[nH]ncc3c2)ccn1.
What is the InChIKey of 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide?
The InChIKey is JGWNDRGBWUYYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O/c20-17-10-14(6-7-21-17)23-15-8-12-11-22-25-18(12)16(9-15)19(26)24-13-4-2-1-3-5-13/h1-11H,(H,22,25)(H,24,26)(H3,20,21,23).
What are the key properties of 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide?
5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide has a molecular weight of 344.38 g/mol, XLogP of 3.54, 4 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-amino-4-pyridinyl)amino]-N-phenyl-1H-indazole-7-carboxamide is sourced from PubChem (CID 59023830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).