(7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

C20H15N5O2 — CID 156850843

About (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile

(7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile (PubChem CID 156850843) has the molecular formula C20H15N5O2 and a molecular weight of 357.37 g/mol. Its IUPAC name is (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile.

Molecular Properties

• Compound Name: (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
• PubChem CID: 156850843
• Molecular Formula: C20H15N5O2
• Molecular Weight: 357.37 g/mol
• Exact Mass: 357.12
• IUPAC Name: (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile
• SMILES: Cc1c(C#N)cnc2c1CC[C@H]2Oc1ccc2[nH]nc(-c3cnco3)c2c1
• InChI: InChI=1S/C20H15N5O2/c1-11-12(7-21)8-23-19-14(11)3-5-17(19)27-13-2-4-16-15(6-13)20(25-24-16)18-9-22-10-26-18/h2,4,6,8-10,17H,3,5H2,1H3,(H,24,25)/t17-/m1/s1
• InChIKey: PRMBEULZMQJOGB-QGZVFWFLSA-N
• XLogP: 3.86
• TPSA: 100.62 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 3
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	357.37
LogP ≤ 5	3.86
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?

The IUPAC name of (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile (CID 156850843) is (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile.

What is the SMILES notation for (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?

The canonical SMILES for (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile is Cc1c(C#N)cnc2c1CC[C@H]2Oc1ccc2[nH]nc(-c3cnco3)c2c1.

What is the InChIKey of (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?

The InChIKey is PRMBEULZMQJOGB-QGZVFWFLSA-N. The full InChI is InChI=1S/C20H15N5O2/c1-11-12(7-21)8-23-19-14(11)3-5-17(19)27-13-2-4-16-15(6-13)20(25-24-16)18-9-22-10-26-18/h2,4,6,8-10,17H,3,5H2,1H3,(H,24,25)/t17-/m1/s1.

What are the key properties of (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile?

(7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile has a molecular weight of 357.37 g/mol, XLogP of 3.86, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for (7R)-4-methyl-7-[[3-(1,3-oxazol-5-yl)-1H-indazol-5-yl]oxy]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile is sourced from PubChem (CID 156850843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).