4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane

C90H85N23O3 — CID 165002931

About 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane

4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane (PubChem CID 165002931) has the molecular formula C90H85N23O3 and a molecular weight of 1536.83 g/mol. Its IUPAC name is 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane.

Molecular Properties

• Compound Name: 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane
• PubChem CID: 165002931
• Molecular Formula: C90H85N23O3
• Molecular Weight: 1536.83 g/mol
• Exact Mass: 1535.72
• IUPAC Name: 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane
• SMILES: C.C#Cc1cc(OC2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)ccn1.C#Cc1cccc(OC2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)c1.Cn1cc(-c2cc(-c3ccc(N4CCC(OCCC#CCN5CCC5)CC4)nc3)c3c(C#N)cnn3c2)cn1
• InChI: InChI=1S/C30H32N8O.C30H25N7O.C29H24N8O.CH4/c1-35-21-26(20-33-35)24-16-28(30-25(17-31)19-34-38(30)22-24)23-6-7-29(32-18-23)37-13-8-27(9-14-37)39-15-4-2-3-10-36-11-5-12-36;1-3-21-5-4-6-27(13-21)38-26-9-11-36(12-10-26)29-8-7-22(16-32-29)28-14-23(25-18-33-35(2)19-25)20-37-30(28)24(15-31)17-34-37;1-3-24-13-26(6-9-31-24)38-25-7-10-36(11-8-25)28-5-4-20(15-32-28)27-12-21(23-17-33-35(2)18-23)19-37-29(27)22(14-30)16-34-37;/h6-7,16,18-22,27H,4-5,8-15H2,1H3;1,4-8,13-14,16-20,26H,9-12H2,2H3;1,4-6,9,12-13,15-19,25H,7-8,10-11H2,2H3;1H4
• InChIKey: INGNAUXLDQKFBK-UHFFFAOYSA-N
• XLogP: 13.18
• TPSA: 268.94 Ų
• H-Bond Acceptors: 26
• Rotatable Bonds: 17
• Heavy Atoms: 116
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1536.83
LogP ≤ 5	13.18
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane?

The IUPAC name of 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane (CID 165002931) is 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane.

What is the SMILES notation for 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane?

The canonical SMILES for 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane is C.C#Cc1cc(OC2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)ccn1.C#Cc1cccc(OC2CCN(c3ccc(-c4cc(-c5cnn(C)c5)cn5ncc(C#N)c45)cn3)CC2)c1.Cn1cc(-c2cc(-c3ccc(N4CCC(OCCC#CCN5CCC5)CC4)nc3)c3c(C#N)cnn3c2)cn1.

What is the InChIKey of 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane?

The InChIKey is INGNAUXLDQKFBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32N8O.C30H25N7O.C29H24N8O.CH4/c1-35-21-26(20-33-35)24-16-28(30-25(17-31)19-34-38(30)22-24)23-6-7-29(32-18-23)37-13-8-27(9-14-37)39-15-4-2-3-10-36-11-5-12-36;1-3-21-5-4-6-27(13-21)38-26-9-11-36(12-10-26)29-8-7-22(16-32-29)28-14-23(25-18-33-35(2)19-25)20-37-30(28)24(15-31)17-34-37;1-3-24-13-26(6-9-31-24)38-25-7-10-36(11-8-25)28-5-4-20(15-32-28)27-12-21(23-17-33-35(2)18-23)19-37-29(27)22(14-30)16-34-37;/h6-7,16,18-22,27H,4-5,8-15H2,1H3;1,4-8,13-14,16-20,26H,9-12H2,2H3;1,4-6,9,12-13,15-19,25H,7-8,10-11H2,2H3;1H4.

What are the key properties of 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane?

4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane has a molecular weight of 1536.83 g/mol, XLogP of 13.18, 17 rotatable bonds, 0 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[6-[4-[5-(azetidin-1-yl)pent-3-ynoxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-(3-ethynylphenoxy)piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[4-[(2-ethynyl-4-pyridinyl)oxy]piperidin-1-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;methane is sourced from PubChem (CID 165002931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).