2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol

C114H135N13O10 — CID 160649328

IUPAC2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol
SMILESO=C(NC1CC1)c1cccc(C(O)c2c(C3CC3)ccc3cncn23)c1.O=C1C2CCC(C2)C1C(O)c1c(C2CC2)ccc2cncn12.OC(CC12CC3CC(CC(C3)C1)C2)c1c(C2CC2)ccc2cncn12.OC(c1c(C2CC2)ccc2cncn12)C1CC2CCC1C2.OC1CC2CC1CC2C(O)c1c(C2CC2)ccc2cncn12.OC1CCCC(C(O)c2c(C3CC3)ccc3cncn23)C1
InChIInChI=1S/C22H28N2O.C21H21N3O2.C18H22N2O2.C18H20N2O2.C18H22N2O.C17H22N2O2/c25-20(11-22-8-14-5-15(9-22)7-16(6-14)10-22)21-19(17-1-2-17)4-3-18-12-23-13-24(18)21;25-20(14-2-1-3-15(10-14)21(26)23-16-6-7-16)19-18(13-4-5-13)9-8-17-11-22-12-24(17)19;21-16-7-11-5-12(16)6-15(11)18(22)17-14(10-1-2-10)4-3-13-8-19-9-20(13)17;21-17-12-4-3-11(7-12)15(17)18(22)16-14(10-1-2-10)6-5-13-8-19-9-20(13)16;21-18(16-8-11-1-2-13(16)7-11)17-15(12-3-4-12)6-5-14-9-19-10-20(14)17;20-14-3-1-2-12(8-14)17(21)16-15(11-4-5-11)7-6-13-9-18-10-19(13)16/h3-4,12-17,20,25H,1-2,5-11H2;1-3,8-13,16,20,25H,4-7H2,(H,23,26);3-4,8-12,15-16,18,21-22H,1-2,5-7H2;5-6,8-12,15,18,22H,1-4,7H2;5-6,9-13,16,18,21H,1-4,7-8H2;6-7,9-12,14,17,20-21H,1-5,8H2
InChIKeyRKFCOZQDERBHJR-UHFFFAOYSA-N
MW1847.41 g/mol
LogP20.03
Rot. Bonds21

About 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol

2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol (PubChem CID 160649328) has the molecular formula C114H135N13O10 and a molecular weight of 1847.41 g/mol. Its IUPAC name is 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol
PubChem CID160649328
Molecular FormulaC114H135N13O10
Molecular Weight1847.41 g/mol
Exact Mass1846.05
IUPAC Name2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol
SMILESO=C(NC1CC1)c1cccc(C(O)c2c(C3CC3)ccc3cncn23)c1.O=C1C2CCC(C2)C1C(O)c1c(C2CC2)ccc2cncn12.OC(CC12CC3CC(CC(C3)C1)C2)c1c(C2CC2)ccc2cncn12.OC(c1c(C2CC2)ccc2cncn12)C1CC2CCC1C2.OC1CC2CC1CC2C(O)c1c(C2CC2)ccc2cncn12.OC1CCCC(C(O)c2c(C3CC3)ccc3cncn23)C1
InChIInChI=1S/C22H28N2O.C21H21N3O2.C18H22N2O2.C18H20N2O2.C18H22N2O.C17H22N2O2/c25-20(11-22-8-14-5-15(9-22)7-16(6-14)10-22)21-19(17-1-2-17)4-3-18-12-23-13-24(18)21;25-20(14-2-1-3-15(10-14)21(26)23-16-6-7-16)19-18(13-4-5-13)9-8-17-11-22-12-24(17)19;21-16-7-11-5-12(16)6-15(11)18(22)17-14(10-1-2-10)4-3-13-8-19-9-20(13)17;21-17-12-4-3-11(7-12)15(17)18(22)16-14(10-1-2-10)6-5-13-8-19-9-20(13)16;21-18(16-8-11-1-2-13(16)7-11)17-15(12-3-4-12)6-5-14-9-19-10-20(14)17;20-14-3-1-2-12(8-14)17(21)16-15(11-4-5-11)7-6-13-9-18-10-19(13)16/h3-4,12-17,20,25H,1-2,5-11H2;1-3,8-13,16,20,25H,4-7H2,(H,23,26);3-4,8-12,15-16,18,21-22H,1-2,5-7H2;5-6,8-12,15,18,22H,1-4,7H2;5-6,9-13,16,18,21H,1-4,7-8H2;6-7,9-12,14,17,20-21H,1-5,8H2
InChIKeyRKFCOZQDERBHJR-UHFFFAOYSA-N
XLogP20.03
TPSA311.81 Ų
H-Bond Donors9
H-Bond Acceptors22
Rotatable Bonds21
Heavy Atoms137
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001847.41
LogP ≤ 520.03
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1022

Analyze 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol?
The IUPAC name of 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol (CID 160649328) is 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol.
What is the SMILES notation for 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol?
The canonical SMILES for 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol is O=C(NC1CC1)c1cccc(C(O)c2c(C3CC3)ccc3cncn23)c1.O=C1C2CCC(C2)C1C(O)c1c(C2CC2)ccc2cncn12.OC(CC12CC3CC(CC(C3)C1)C2)c1c(C2CC2)ccc2cncn12.OC(c1c(C2CC2)ccc2cncn12)C1CC2CCC1C2.OC1CC2CC1CC2C(O)c1c(C2CC2)ccc2cncn12.OC1CCCC(C(O)c2c(C3CC3)ccc3cncn23)C1.
What is the InChIKey of 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol?
The InChIKey is RKFCOZQDERBHJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H28N2O.C21H21N3O2.C18H22N2O2.C18H20N2O2.C18H22N2O.C17H22N2O2/c25-20(11-22-8-14-5-15(9-22)7-16(6-14)10-22)21-19(17-1-2-17)4-3-18-12-23-13-24(18)21;25-20(14-2-1-3-15(10-14)21(26)23-16-6-7-16)19-18(13-4-5-13)9-8-17-11-22-12-24(17)19;21-16-7-11-5-12(16)6-15(11)18(22)17-14(10-1-2-10)4-3-13-8-19-9-20(13)17;21-17-12-4-3-11(7-12)15(17)18(22)16-14(10-1-2-10)6-5-13-8-19-9-20(13)16;21-18(16-8-11-1-2-13(16)7-11)17-15(12-3-4-12)6-5-14-9-19-10-20(14)17;20-14-3-1-2-12(8-14)17(21)16-15(11-4-5-11)7-6-13-9-18-10-19(13)16/h3-4,12-17,20,25H,1-2,5-11H2;1-3,8-13,16,20,25H,4-7H2,(H,23,26);3-4,8-12,15-16,18,21-22H,1-2,5-7H2;5-6,8-12,15,18,22H,1-4,7H2;5-6,9-13,16,18,21H,1-4,7-8H2;6-7,9-12,14,17,20-21H,1-5,8H2.
What are the key properties of 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol?
2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol has a molecular weight of 1847.41 g/mol, XLogP of 20.03, 21 rotatable bonds, 9 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-adamantyl)-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;2-bicyclo[2.2.1]heptanyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;N-cyclopropyl-3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]benzamide;5-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-ol;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]bicyclo[2.2.1]heptan-2-one;3-[(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol is sourced from PubChem (CID 160649328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).