4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

C25H25FN8O — CID 176863990

About 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 176863990) has the molecular formula C25H25FN8O and a molecular weight of 472.53 g/mol. Its IUPAC name is 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

• Compound Name: 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
• PubChem CID: 176863990
• Molecular Formula: C25H25FN8O
• Molecular Weight: 472.53 g/mol
• Exact Mass: 472.21
• IUPAC Name: 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
• SMILES: Cc1c(-c2cc(OCC3(c4ccc(F)cn4)CC3)c3c(C#N)cnn3c2)nnn1C1CCNCC1
• InChI: InChI=1S/C25H25FN8O/c1-16-23(31-32-34(16)20-4-8-28-9-5-20)17-10-21(24-18(11-27)12-30-33(24)14-17)35-15-25(6-7-25)22-3-2-19(26)13-29-22/h2-3,10,12-14,20,28H,4-9,15H2,1H3
• InChIKey: BEGWAOUUWVUXEB-UHFFFAOYSA-N
• XLogP: 3.34
• TPSA: 105.95 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 9
• Rotatable Bonds: 6
• Heavy Atoms: 35
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	472.53
LogP ≤ 5	3.34
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	9

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The IUPAC name of 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 176863990) is 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

What is the SMILES notation for 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The canonical SMILES for 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is Cc1c(-c2cc(OCC3(c4ccc(F)cn4)CC3)c3c(C#N)cnn3c2)nnn1C1CCNCC1.

What is the InChIKey of 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

The InChIKey is BEGWAOUUWVUXEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H25FN8O/c1-16-23(31-32-34(16)20-4-8-28-9-5-20)17-10-21(24-18(11-27)12-30-33(24)14-17)35-15-25(6-7-25)22-3-2-19(26)13-29-22/h2-3,10,12-14,20,28H,4-9,15H2,1H3.

What are the key properties of 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?

4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 472.53 g/mol, XLogP of 3.34, 6 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[[1-(5-fluoro-2-pyridinyl)cyclopropyl]methoxy]-6-(5-methyl-1-piperidin-4-yltriazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 176863990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).