5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide

C16H12N6O2 — CID 156586863

IUPAC5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2noc3ncccc23)cnn1-c1ccccn1
InChIInChI=1S/C16H12N6O2/c1-10-12(9-19-22(10)13-6-2-3-7-17-13)15(23)20-14-11-5-4-8-18-16(11)24-21-14/h2-9H,1H3,(H,20,21,23)
InChIKeyNGHWQOFVICOYOC-UHFFFAOYSA-N
MW320.31 g/mol
LogP2.36
Rot. Bonds3

About 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide

5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide (PubChem CID 156586863) has the molecular formula C16H12N6O2 and a molecular weight of 320.31 g/mol. Its IUPAC name is 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide
PubChem CID156586863
Molecular FormulaC16H12N6O2
Molecular Weight320.31 g/mol
Exact Mass320.10
IUPAC Name5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide
SMILESCc1c(C(=O)Nc2noc3ncccc23)cnn1-c1ccccn1
InChIInChI=1S/C16H12N6O2/c1-10-12(9-19-22(10)13-6-2-3-7-17-13)15(23)20-14-11-5-4-8-18-16(11)24-21-14/h2-9H,1H3,(H,20,21,23)
InChIKeyNGHWQOFVICOYOC-UHFFFAOYSA-N
XLogP2.36
TPSA98.73 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.31
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The IUPAC name of 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide (CID 156586863) is 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide is Cc1c(C(=O)Nc2noc3ncccc23)cnn1-c1ccccn1.
What is the InChIKey of 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide?
The InChIKey is NGHWQOFVICOYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N6O2/c1-10-12(9-19-22(10)13-6-2-3-7-17-13)15(23)20-14-11-5-4-8-18-16(11)24-21-14/h2-9H,1H3,(H,20,21,23).
What are the key properties of 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide?
5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide has a molecular weight of 320.31 g/mol, XLogP of 2.36, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-([1,2]oxazolo[5,4-b]pyridin-3-yl)-1-pyridin-2-ylpyrazole-4-carboxamide is sourced from PubChem (CID 156586863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).