benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol

C113H134F3N15O11S — CID 159821079

About benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol

benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol (PubChem CID 159821079) has the molecular formula C113H134F3N15O11S and a molecular weight of 1967.47 g/mol. Its IUPAC name is benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol.

Molecular Properties

• Compound Name: benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol
• PubChem CID: 159821079
• Molecular Formula: C113H134F3N15O11S
• Molecular Weight: 1967.47 g/mol
• Exact Mass: 1966.01
• IUPAC Name: benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol
• SMILES: CS(=O)(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1.O=C(NC1CC1)c1cccc(C(O)c2c(C3CC3)ccn3cncc23)c1.O=C(OCc1ccccc1)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1.OC(c1c([C@H]2C[C@@H]2F)ccn2cncc12)C1CCCCC1.OC(c1c([C@H]2C[C@H]2F)ccn2cncc12)C1CCCCC1.OC(c1c([C@H]2C[C@H]2F)ccn2cncc12)C1CCCCC1
• InChI: InChI=1S/C24H27N3O3.C21H21N3O2.3C17H21FN2O.C17H23N3O3S/c28-23(22-20(18-8-9-18)10-12-27-16-25-13-21(22)27)19-7-4-11-26(14-19)24(29)30-15-17-5-2-1-3-6-17;25-20(14-2-1-3-15(10-14)21(26)23-16-6-7-16)19-17(13-4-5-13)8-9-24-12-22-11-18(19)24;3*18-14-8-13(14)12-6-7-20-10-19-9-15(20)16(12)17(21)11-4-2-1-3-5-11;1-24(22,23)20-7-2-3-13(10-20)17(21)16-14(12-4-5-12)6-8-19-11-18-9-15(16)19/h1-3,5-6,10,12-13,16,18-19,23,28H,4,7-9,11,14-15H2;1-3,8-13,16,20,25H,4-7H2,(H,23,26);3*6-7,9-11,13-14,17,21H,1-5,8H2;6,8-9,11-13,17,21H,2-5,7,10H2,1H3/t;;13-,14+,17?;2*13-,14-,17?;/m..111./s1
• InChIKey: NMFZQMNLNPYNLK-PFLONWTBSA-N
• XLogP: 20.72
• TPSA: 321.20 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 23
• Rotatable Bonds: 23
• Heavy Atoms: 143
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1967.47
LogP ≤ 5	20.72
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	23

Frequently Asked Questions

What is the IUPAC name of benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol?

The IUPAC name of benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol (CID 159821079) is benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol.

What is the SMILES notation for benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol?

The canonical SMILES for benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol is CS(=O)(=O)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1.O=C(NC1CC1)c1cccc(C(O)c2c(C3CC3)ccn3cncc23)c1.O=C(OCc1ccccc1)N1CCCC(C(O)c2c(C3CC3)ccn3cncc23)C1.OC(c1c([C@H]2C[C@@H]2F)ccn2cncc12)C1CCCCC1.OC(c1c([C@H]2C[C@H]2F)ccn2cncc12)C1CCCCC1.OC(c1c([C@H]2C[C@H]2F)ccn2cncc12)C1CCCCC1.

What is the InChIKey of benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol?

The InChIKey is NMFZQMNLNPYNLK-PFLONWTBSA-N. The full InChI is InChI=1S/C24H27N3O3.C21H21N3O2.3C17H21FN2O.C17H23N3O3S/c28-23(22-20(18-8-9-18)10-12-27-16-25-13-21(22)27)19-7-4-11-26(14-19)24(29)30-15-17-5-2-1-3-6-17;25-20(14-2-1-3-15(10-14)21(26)23-16-6-7-16)19-17(13-4-5-13)8-9-24-12-22-11-18(19)24;3*18-14-8-13(14)12-6-7-20-10-19-9-15(20)16(12)17(21)11-4-2-1-3-5-11;1-24(22,23)20-7-2-3-13(10-20)17(21)16-14(12-4-5-12)6-8-19-11-18-9-15(16)19/h1-3,5-6,10,12-13,16,18-19,23,28H,4,7-9,11,14-15H2;1-3,8-13,16,20,25H,4-7H2,(H,23,26);3*6-7,9-11,13-14,17,21H,1-5,8H2;6,8-9,11-13,17,21H,2-5,7,10H2,1H3/t;;13-,14+,17?;2*13-,14-,17?;/m..111./s1.

What are the key properties of benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol?

benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol has a molecular weight of 1967.47 g/mol, XLogP of 20.72, 23 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for benzyl 3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]piperidine-1-carboxylate;bis(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol);cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol;N-cyclopropyl-3-[(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-hydroxymethyl]benzamide;(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-methylsulfonylpiperidin-3-yl)methanol is sourced from PubChem (CID 159821079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).