2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide

C19H21N5O2 — CID 90119450

IUPAC2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1nccc2nn(Cc3cnc(OC4CCC4)c(C)c3)cc12
InChIInChI=1S/C19H21N5O2/c1-12-8-13(9-22-19(12)26-14-4-3-5-14)10-24-11-15-16(23-24)6-7-21-17(15)18(25)20-2/h6-9,11,14H,3-5,10H2,1-2H3,(H,20,25)
InChIKeyFZQFLFKUIPSPNN-UHFFFAOYSA-N
MW351.41 g/mol
LogP2.47
Rot. Bonds5

About 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide

2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide (PubChem CID 90119450) has the molecular formula C19H21N5O2 and a molecular weight of 351.41 g/mol. Its IUPAC name is 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide
PubChem CID90119450
Molecular FormulaC19H21N5O2
Molecular Weight351.41 g/mol
Exact Mass351.17
IUPAC Name2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide
SMILESCNC(=O)c1nccc2nn(Cc3cnc(OC4CCC4)c(C)c3)cc12
InChIInChI=1S/C19H21N5O2/c1-12-8-13(9-22-19(12)26-14-4-3-5-14)10-24-11-15-16(23-24)6-7-21-17(15)18(25)20-2/h6-9,11,14H,3-5,10H2,1-2H3,(H,20,25)
InChIKeyFZQFLFKUIPSPNN-UHFFFAOYSA-N
XLogP2.47
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.41
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide?
The IUPAC name of 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide (CID 90119450) is 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide.
What is the SMILES notation for 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide?
The canonical SMILES for 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide is CNC(=O)c1nccc2nn(Cc3cnc(OC4CCC4)c(C)c3)cc12.
What is the InChIKey of 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide?
The InChIKey is FZQFLFKUIPSPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O2/c1-12-8-13(9-22-19(12)26-14-4-3-5-14)10-24-11-15-16(23-24)6-7-21-17(15)18(25)20-2/h6-9,11,14H,3-5,10H2,1-2H3,(H,20,25).
What are the key properties of 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide?
2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide has a molecular weight of 351.41 g/mol, XLogP of 2.47, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-cyclobutyloxy-5-methyl-3-pyridinyl)methyl]-N-methylpyrazolo[4,3-c]pyridine-4-carboxamide is sourced from PubChem (CID 90119450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).