[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone

C94H96N20O4 — CID 157119874

IUPAC[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone
SMILESCc1ccc(NC2CC3CC2N(C(=O)c2cc(C)cnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2cccnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2nccc(C)c2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2ncccc2-c2ccccn2)C3)nc1
InChIInChI=1S/2C24H25N5O.2C23H23N5O/c1-15-6-7-21(27-13-15)28-19-11-17-12-20(19)29(14-17)24(30)23-22(16(2)8-10-26-23)18-5-3-4-9-25-18;1-15-6-7-22(26-12-15)28-20-10-17-11-21(20)29(14-17)24(30)18-9-16(2)13-27-23(18)19-5-3-4-8-25-19;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)17-5-4-10-25-22(17)18-6-2-3-9-24-18;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)22-17(5-4-10-25-22)18-6-2-3-9-24-18/h3-10,13,17,19-20H,11-12,14H2,1-2H3,(H,27,28);3-9,12-13,17,20-21H,10-11,14H2,1-2H3,(H,26,28);2*2-10,13,16,19-20H,11-12,14H2,1H3,(H,26,27)
InChIKeyAHVNSYLATCPIQD-UHFFFAOYSA-N
MW1569.94 g/mol
LogP14.87
Rot. Bonds16

About [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone

[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone (PubChem CID 157119874) has the molecular formula C94H96N20O4 and a molecular weight of 1569.94 g/mol. Its IUPAC name is [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone.

Molecular Properties

Compound Name[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone
PubChem CID157119874
Molecular FormulaC94H96N20O4
Molecular Weight1569.94 g/mol
Exact Mass1568.79
IUPAC Name[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone
SMILESCc1ccc(NC2CC3CC2N(C(=O)c2cc(C)cnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2cccnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2nccc(C)c2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2ncccc2-c2ccccn2)C3)nc1
InChIInChI=1S/2C24H25N5O.2C23H23N5O/c1-15-6-7-21(27-13-15)28-19-11-17-12-20(19)29(14-17)24(30)23-22(16(2)8-10-26-23)18-5-3-4-9-25-18;1-15-6-7-22(26-12-15)28-20-10-17-11-21(20)29(14-17)24(30)18-9-16(2)13-27-23(18)19-5-3-4-8-25-19;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)17-5-4-10-25-22(17)18-6-2-3-9-24-18;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)22-17(5-4-10-25-22)18-6-2-3-9-24-18/h3-10,13,17,19-20H,11-12,14H2,1-2H3,(H,27,28);3-9,12-13,17,20-21H,10-11,14H2,1-2H3,(H,26,28);2*2-10,13,16,19-20H,11-12,14H2,1H3,(H,26,27)
InChIKeyAHVNSYLATCPIQD-UHFFFAOYSA-N
XLogP14.87
TPSA284.04 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds16
Heavy Atoms118
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001569.94
LogP ≤ 514.87
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Analyze [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

NX-5948
CID 156464216
3-[[6-[1-[[(3R)-1-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]pyrrolidin-3-yl]methyl]piperidin-4-yl]-3-pyridinyl]amino]-5-[(3R)-3-(3-methyl-2-oxoimidazolidin-1-yl)piperidin-1-yl]pyrazine-2-carboxamide
CID 156551376
[2-(3-methyl-2-pyridinyl)-3-pyridinyl]-[(1S,4R,6R)-6-[[5-(trifluoromethyl)-2-pyridinyl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631018
[2-(3-methylpyridin-2-yl)pyridin-3-yl]-[(1S,4S,6R)-6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631019
[3-(3-methyl-2-pyridinyl)-2-pyridinyl]-[(1S,4R,6R)-6-[[5-(trifluoromethyl)-2-pyridinyl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631051
[3-(3-methylpyridin-2-yl)pyridin-2-yl]-[(1S,4S,6R)-6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631052
(6-methyl-2-pyridin-2-yl-3-pyridinyl)-[(1S,4R,6R)-6-[[5-(trifluoromethyl)-2-pyridinyl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631143
(6-methyl-2-pyridin-2-ylpyridin-3-yl)-[(1S,4S,6R)-6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631144
(5-methyl-3-pyridin-2-yl-2-pyridinyl)-[(1S,4R,6R)-6-[[5-(trifluoromethyl)-2-pyridinyl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631530
(5-methyl-3-pyridin-2-ylpyridin-2-yl)-[(1S,4S,6R)-6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117631531
[4-Methyl-3-(3-methylpyridin-2-yl)pyridin-2-yl]-[6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117636976
(5-Methyl-2-pyridin-2-ylpyridin-3-yl)-[6-[[5-(trifluoromethyl)pyridin-2-yl]amino]-2-azabicyclo[2.2.1]heptan-2-yl]methanone
CID 117637227

Frequently Asked Questions

What is the IUPAC name of [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone?
The IUPAC name of [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone (CID 157119874) is [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone.
What is the SMILES notation for [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone?
The canonical SMILES for [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone is Cc1ccc(NC2CC3CC2N(C(=O)c2cc(C)cnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2cccnc2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2nccc(C)c2-c2ccccn2)C3)nc1.Cc1ccc(NC2CC3CC2N(C(=O)c2ncccc2-c2ccccn2)C3)nc1.
What is the InChIKey of [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone?
The InChIKey is AHVNSYLATCPIQD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C24H25N5O.2C23H23N5O/c1-15-6-7-21(27-13-15)28-19-11-17-12-20(19)29(14-17)24(30)23-22(16(2)8-10-26-23)18-5-3-4-9-25-18;1-15-6-7-22(26-12-15)28-20-10-17-11-21(20)29(14-17)24(30)18-9-16(2)13-27-23(18)19-5-3-4-8-25-19;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)17-5-4-10-25-22(17)18-6-2-3-9-24-18;1-15-7-8-21(26-13-15)27-19-11-16-12-20(19)28(14-16)23(29)22-17(5-4-10-25-22)18-6-2-3-9-24-18/h3-10,13,17,19-20H,11-12,14H2,1-2H3,(H,27,28);3-9,12-13,17,20-21H,10-11,14H2,1-2H3,(H,26,28);2*2-10,13,16,19-20H,11-12,14H2,1H3,(H,26,27).
What are the key properties of [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone?
[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone has a molecular weight of 1569.94 g/mol, XLogP of 14.87, 16 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(4-methyl-3-pyridin-2-yl-2-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(5-methyl-2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(2-pyridin-2-yl-3-pyridinyl)methanone;[6-[(5-methyl-2-pyridinyl)amino]-2-azabicyclo[2.2.1]heptan-2-yl]-(3-pyridin-2-yl-2-pyridinyl)methanone is sourced from PubChem (CID 157119874), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).