4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile

C63H59Br2N13 — CID 159033069

About 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile

4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile (PubChem CID 159033069) has the molecular formula C63H59Br2N13 and a molecular weight of 1158.06 g/mol. Its IUPAC name is 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile.

Molecular Properties

• Compound Name: 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile
• PubChem CID: 159033069
• Molecular Formula: C63H59Br2N13
• Molecular Weight: 1158.06 g/mol
• Exact Mass: 1155.34
• IUPAC Name: 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile
• SMILES: Cc1ccn2ncc(-c3ccc(-c4cnn(C)c4)cc3)c2c1C1=CCC(C#N)CC1.Cc1ccn2ncc(Br)c2c1C1=CCC(C#N)CC1.Cc1ccn2nccc2c1Br.Cc1ccn2nccc2c1C1=CCC(C#N)CC1
• InChI: InChI=1S/C25H23N5.C15H14BrN3.C15H15N3.C8H7BrN2/c1-17-11-12-30-25(24(17)21-5-3-18(13-26)4-6-21)23(15-28-30)20-9-7-19(8-10-20)22-14-27-29(2)16-22;1-10-6-7-19-15(13(16)9-18-19)14(10)12-4-2-11(8-17)3-5-12;1-11-7-9-18-14(6-8-17-18)15(11)13-4-2-12(10-16)3-5-13;1-6-3-5-11-7(8(6)9)2-4-10-11/h5,7-12,14-16,18H,3-4,6H2,1-2H3;4,6-7,9,11H,2-3,5H2,1H3;4,6-9,12H,2-3,5H2,1H3;2-5H,1H3
• InChIKey: JVCVOZZBTHYCNY-UHFFFAOYSA-N
• XLogP: 15.28
• TPSA: 158.39 Ų
• H-Bond Acceptors: 13
• Rotatable Bonds: 5
• Heavy Atoms: 78
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1158.06
LogP ≤ 5	15.28
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	13

Frequently Asked Questions

What is the IUPAC name of 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile?

The IUPAC name of 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile (CID 159033069) is 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile.

What is the SMILES notation for 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile?

The canonical SMILES for 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile is Cc1ccn2ncc(-c3ccc(-c4cnn(C)c4)cc3)c2c1C1=CCC(C#N)CC1.Cc1ccn2ncc(Br)c2c1C1=CCC(C#N)CC1.Cc1ccn2nccc2c1Br.Cc1ccn2nccc2c1C1=CCC(C#N)CC1.

What is the InChIKey of 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile?

The InChIKey is JVCVOZZBTHYCNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5.C15H14BrN3.C15H15N3.C8H7BrN2/c1-17-11-12-30-25(24(17)21-5-3-18(13-26)4-6-21)23(15-28-30)20-9-7-19(8-10-20)22-14-27-29(2)16-22;1-10-6-7-19-15(13(16)9-18-19)14(10)12-4-2-11(8-17)3-5-12;1-11-7-9-18-14(6-8-17-18)15(11)13-4-2-12(10-16)3-5-13;1-6-3-5-11-7(8(6)9)2-4-10-11/h5,7-12,14-16,18H,3-4,6H2,1-2H3;4,6-7,9,11H,2-3,5H2,1H3;4,6-9,12H,2-3,5H2,1H3;2-5H,1H3.

What are the key properties of 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile?

4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile has a molecular weight of 1158.06 g/mol, XLogP of 15.28, 5 rotatable bonds, 0 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 4-bromo-5-methylpyrazolo[1,5-a]pyridine;4-(3-bromo-5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile;4-[5-methyl-3-[4-(1-methylpyrazol-4-yl)phenyl]pyrazolo[1,5-a]pyridin-4-yl]cyclohex-3-ene-1-carbonitrile;4-(5-methylpyrazolo[1,5-a]pyridin-4-yl)cyclohex-3-ene-1-carbonitrile is sourced from PubChem (CID 159033069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).