methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

C61H64N18O2 — CID 164995318

IUPACmethane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESC.C.COc1ccc(CN(C)C2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1.COc1ccc(CNC2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1
InChIInChI=1S/C30H29N9O.C29H27N9O.2CH4/c1-36(14-19-4-7-28(40-3)33-10-19)30-25-17-38(18-26(25)30)27-6-5-20(11-32-27)24-8-21(23-13-34-37(2)15-23)16-39-29(24)22(9-31)12-35-39;1-36-14-22(13-34-36)20-7-23(29-21(8-30)12-35-38(29)15-20)19-4-5-26(31-11-19)37-16-24-25(17-37)28(24)33-10-18-3-6-27(39-2)32-9-18;;/h4-8,10-13,15-16,25-26,30H,14,17-18H2,1-3H3;3-7,9,11-15,24-25,28,33H,10,16-17H2,1-2H3;2*1H4/t25-,26+,30?;24-,25+,28?;;
InChIKeyHLXWLEDXZDTMGS-SVUULFQSSA-N
MW1081.31 g/mol
LogP8.21
Rot. Bonds14

About methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile

methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 164995318) has the molecular formula C61H64N18O2 and a molecular weight of 1081.31 g/mol. Its IUPAC name is methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Namemethane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID164995318
Molecular FormulaC61H64N18O2
Molecular Weight1081.31 g/mol
Exact Mass1080.55
IUPAC Namemethane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESC.C.COc1ccc(CN(C)C2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1.COc1ccc(CNC2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1
InChIInChI=1S/C30H29N9O.C29H27N9O.2CH4/c1-36(14-19-4-7-28(40-3)33-10-19)30-25-17-38(18-26(25)30)27-6-5-20(11-32-27)24-8-21(23-13-34-37(2)15-23)16-39-29(24)22(9-31)12-35-39;1-36-14-22(13-34-36)20-7-23(29-21(8-30)12-35-38(29)15-20)19-4-5-26(31-11-19)37-16-24-25(17-37)28(24)33-10-18-3-6-27(39-2)32-9-18;;/h4-8,10-13,15-16,25-26,30H,14,17-18H2,1-3H3;3-7,9,11-15,24-25,28,33H,10,16-17H2,1-2H3;2*1H4/t25-,26+,30?;24-,25+,28?;;
InChIKeyHLXWLEDXZDTMGS-SVUULFQSSA-N
XLogP8.21
TPSA209.59 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds14
Heavy Atoms81
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001081.31
LogP ≤ 58.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile with MolForge

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Launch Full Analysis

Related Compounds

US10023570, Example 457
CID 124199389
US10023570, Example 736
CID 124200174
US10023570, Example 666
CID 124200183
US10023570, Example 696
CID 124200223
US10023570, Example 675
CID 126740221
US10174028, Example 688
CID 135165770
6-(5,6-dihydro-4H-pyrrolo[2,1-e]pyrazol-3-yl)-4-[6-[4-[(6-methoxy-3-pyridinyl)methyl]piperazin-1-yl]-3-pyridinyl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 169286253
4-[6-[6-[(6-Methoxy-3-pyridinyl)methyl]-3,6-diazabicyclo[3.1.1]heptan-3-yl]-3-pyridinyl]-6-[4-(trideuteriomethyl)piperazin-1-yl]pyrazolo[1,5-a]pyridine-3-carbonitrile
CID 168433553
US10023570, Example 713
CID 124199697
US10023570, Example 730
CID 124199726
US10023570, Example 744
CID 124199744
US10023570, Example 700
CID 124199746

Frequently Asked Questions

What is the IUPAC name of methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile (CID 164995318) is methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is C.C.COc1ccc(CN(C)C2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1.COc1ccc(CNC2[C@H]3CN(c4ccc(-c5cc(-c6cnn(C)c6)cn6ncc(C#N)c56)cn4)C[C@@H]23)cn1.
What is the InChIKey of methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is HLXWLEDXZDTMGS-SVUULFQSSA-N. The full InChI is InChI=1S/C30H29N9O.C29H27N9O.2CH4/c1-36(14-19-4-7-28(40-3)33-10-19)30-25-17-38(18-26(25)30)27-6-5-20(11-32-27)24-8-21(23-13-34-37(2)15-23)16-39-29(24)22(9-31)12-35-39;1-36-14-22(13-34-36)20-7-23(29-21(8-30)12-35-38(29)15-20)19-4-5-26(31-11-19)37-16-24-25(17-37)28(24)33-10-18-3-6-27(39-2)32-9-18;;/h4-8,10-13,15-16,25-26,30H,14,17-18H2,1-3H3;3-7,9,11-15,24-25,28,33H,10,16-17H2,1-2H3;2*1H4/t25-,26+,30?;24-,25+,28?;;.
What are the key properties of methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile?
methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 1081.31 g/mol, XLogP of 8.21, 14 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for methane;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile;4-[6-[(1R,5S)-6-[(6-methoxy-3-pyridinyl)methyl-methylamino]-3-azabicyclo[3.1.0]hexan-3-yl]-3-pyridinyl]-6-(1-methylpyrazol-4-yl)pyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 164995318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).