7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide

C20H15N5O2 — CID 170346672

IUPAC7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1cc2c(oc3cccnc32)c(C(N)=O)c1N
InChIInChI=1S/C20H15N5O2/c1-9-4-5-13-12(8-24-25-13)15(9)10-7-11-18-14(3-2-6-23-18)27-19(11)16(17(10)21)20(22)26/h2-8H,21H2,1H3,(H2,22,26)(H,24,25)
InChIKeyYOFMBHKHGYSARE-UHFFFAOYSA-N
MW357.37 g/mol
LogP3.51
Rot. Bonds2

About 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide

7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide (PubChem CID 170346672) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide.

Molecular Properties

Compound Name7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide
PubChem CID170346672
Molecular FormulaC20H15N5O2
Molecular Weight357.37 g/mol
Exact Mass357.12
IUPAC Name7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide
SMILESCc1ccc2[nH]ncc2c1-c1cc2c(oc3cccnc32)c(C(N)=O)c1N
InChIInChI=1S/C20H15N5O2/c1-9-4-5-13-12(8-24-25-13)15(9)10-7-11-18-14(3-2-6-23-18)27-19(11)16(17(10)21)20(22)26/h2-8H,21H2,1H3,(H2,22,26)(H,24,25)
InChIKeyYOFMBHKHGYSARE-UHFFFAOYSA-N
XLogP3.51
TPSA123.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.37
LogP ≤ 53.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

methyl 2,4-diamino-5-(5-methyl-1H-indazol-4-yl)pyridine-3-carboxylate
CID 177042905
3-amino-2-(5-methyl-1H-indazol-4-yl)-6-[2-(propan-2-ylamino)-3-pyridinyl]pyridine-4-carboxamide
CID 170346796
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-(1-methylpyrazol-3-yl)pyridine-2-carboxamide
CID 177283554
5-amino-2-[2-(2,2-dimethylpropanoylamino)-3-pyridinyl]-3-fluoro-6-(5-methyl-1H-indazol-4-yl)pyridine-4-carboxamide
CID 170346548
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-[2-(oxetan-3-yloxy)pyrimidin-4-yl]pyridine-2-carboxamide
CID 177283739
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-(6-morpholin-4-yl-2-pyridinyl)pyridine-2-carboxamide
CID 177283615
3-amino-6-[2-[(2R)-2-amino-2-phenylethoxy]pyrimidin-4-yl]-4-(5-methyl-1H-indazol-4-yl)pyridine-2-carboxamide
CID 177283580
7-(5-methyl-1H-indazol-4-yl)isoquinoline-1-carboxamide
CID 71115097
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-[6-(1,3-thiazol-5-ylmethoxy)-2-pyridinyl]pyridine-2-carboxamide
CID 177283677
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-[2-[2-(1H-pyrazol-5-yl)ethoxy]pyrimidin-4-yl]pyridine-2-carboxamide
CID 177283478
3-amino-4-(5-methyl-1H-indazol-4-yl)-6-[2-(2-pyrazol-1-ylethoxy)pyrimidin-4-yl]pyridine-2-carboxamide
CID 177283533
2-chlorofuro[3,2-b]pyridine-3-carboxamide
CID 144796801

Frequently Asked Questions

What is the IUPAC name of 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide?
The IUPAC name of 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide (CID 170346672) is 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide.
What is the SMILES notation for 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide?
The canonical SMILES for 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide is Cc1ccc2[nH]ncc2c1-c1cc2c(oc3cccnc32)c(C(N)=O)c1N.
What is the InChIKey of 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide?
The InChIKey is YOFMBHKHGYSARE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15N5O2/c1-9-4-5-13-12(8-24-25-13)15(9)10-7-11-18-14(3-2-6-23-18)27-19(11)16(17(10)21)20(22)26/h2-8H,21H2,1H3,(H2,22,26)(H,24,25).
What are the key properties of 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide?
7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide has a molecular weight of 357.37 g/mol, XLogP of 3.51, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-8-(5-methyl-1H-indazol-4-yl)-[1]benzofuro[3,2-b]pyridine-6-carboxamide is sourced from PubChem (CID 170346672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).