2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)

C69H86F4N8O4 — CID 158794525

IUPAC2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)
SMILESOC(CC1CCCCC1)c1c([C@H]2C[C@H]2F)ccn2cncc12.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
InChIInChI=1S/C18H23FN2O.3C17H21FN2O/c19-15-9-14(15)13-6-7-21-11-20-10-16(21)18(13)17(22)8-12-4-2-1-3-5-12;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/h6-7,10-12,14-15,17,22H,1-5,8-9H2;3*6-7,9-11,13-14,17,21H,1-5,8H2/t14-,15-,17?;3*13-,14-,17?/m1111/s1
InChIKeyISRVOORMJBVREK-ARGFFHDVSA-N
MW1167.49 g/mol
LogP15.48
Rot. Bonds13

About 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)

2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) (PubChem CID 158794525) has the molecular formula C69H86F4N8O4 and a molecular weight of 1167.49 g/mol. Its IUPAC name is 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol).

Molecular Properties

Compound Name2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)
PubChem CID158794525
Molecular FormulaC69H86F4N8O4
Molecular Weight1167.49 g/mol
Exact Mass1166.67
IUPAC Name2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)
SMILESOC(CC1CCCCC1)c1c([C@H]2C[C@H]2F)ccn2cncc12.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
InChIInChI=1S/C18H23FN2O.3C17H21FN2O/c19-15-9-14(15)13-6-7-21-11-20-10-16(21)18(13)17(22)8-12-4-2-1-3-5-12;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/h6-7,10-12,14-15,17,22H,1-5,8-9H2;3*6-7,9-11,13-14,17,21H,1-5,8H2/t14-,15-,17?;3*13-,14-,17?/m1111/s1
InChIKeyISRVOORMJBVREK-ARGFFHDVSA-N
XLogP15.48
TPSA150.12 Ų
H-Bond Donors4
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms85
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001167.49
LogP ≤ 515.48
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1012

Analyze 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) with MolForge

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Related Compounds

(7-Cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3,4-difluorophenyl)piperidin-4-yl]methanol
CID 134381379
(1S)-2-cyclohexyl-1-[1-[3-[(S)-hydroxy-[7-(trifluoromethyl)imidazo[1,5-a]pyridin-5-yl]methyl]cyclohexyl]-7-(trifluoromethyl)imidazo[1,5-a]pyridin-5-yl]ethanol
CID 138612190
(7-Cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-(6-fluoro-7,8-dihydroquinolin-4-yl)cyclohexyl]methanol
CID 142308232
Bis(1-cyclohexyl-2-(10-fluoro-4,6,11-triazatricyclo[6.4.0.02,6]dodeca-1(12),2,4,8,10-pentaen-7-yl)ethanol);tetrakis(1-(4,4-difluorocyclohexyl)-2-(4,6,9-triazatricyclo[6.4.0.02,6]dodeca-1(8),2,4,9,11-pentaen-7-yl)ethanol)
CID 157558543
2-[5-[(4,4-Difluorocyclohexyl)-phenylmethyl]-3-(3,5-dimethylimidazol-4-yl)pyrido[3,2-b]indol-7-yl]propan-2-ol
CID 157999971
(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[4-(trifluoromethoxy)phenyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[4-(trifluoromethoxy)phenyl]cyclohexyl]methanol
CID 158278018
(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[2-(trifluoromethyl)phenyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[2-(trifluoromethyl)phenyl]cyclohexyl]methanol
CID 158338826
(1S)-2-cyclohexyl-1-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)ethanol;(S)-cyclohexyl-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)methanol;(1S)-2-cyclohexyl-1-(6-iodoimidazo[1,5-a]pyridin-5-yl)ethanol;(S)-cyclohexyl-(6-iodoimidazo[1,5-a]pyridin-5-yl)methanol;(1S)-2-cyclohexyl-1-[6-(trifluoromethyl)imidazo[1,5-a]pyridin-5-yl]ethanol;(S)-cyclohexyl-[6-(trifluoromethyl)imidazo[1,5-a]pyridin-5-yl]methanol;bis(4-[(S)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-hydroxymethyl]cyclohexan-1-ol);sulfane
CID 158445060
2-[3-(3,5-Dimethylimidazol-4-yl)-5-(4,4,4-trifluoro-1-pyridin-2-ylbutyl)pyrido[3,2-b]indol-7-yl]propan-2-ol
CID 158858327
N-[5-[(1S)-1-(4-ethylpiperazin-1-yl)-3,3,3-trifluoropropyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1R)-1-(4-ethylpiperazin-1-yl)-3,3,3-trifluoropropyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-(1-methylpiperidin-4-yl)methanol;[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-piperidin-4-ylmethanol;(R)-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-piperidin-4-ylmethanol;(S)-[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-piperidin-4-ylmethanol
CID 159034809
N-[5-[(1S)-1-(4-cyclopropylpiperazin-1-yl)propyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1R)-1-(4-cyclopropylpiperazin-1-yl)propyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1S)-1-(4-ethylpiperazin-1-yl)-3,3,3-trifluoropropyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[(1R)-1-(4-ethylpiperazin-1-yl)-3,3,3-trifluoropropyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;N-[5-[1-(4-ethylpiperazin-1-yl)-3,3,3-trifluoropropyl]-2-pyridinyl]-5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-amine;[6-[[5-fluoro-4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]-3-pyridinyl]-piperidin-4-ylmethanol
CID 159054010
7-[2-(3-Cyclopropylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine;1-[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]ethanol;2-[6-[2-(4-fluoro-3-methylphenyl)-3-pyridinyl]imidazo[1,2-a]pyridin-3-yl]propan-2-ol;7-[2-(3-methylphenyl)-3-pyridinyl]imidazo[1,5-a]pyridine;6-[2-[3-(trideuteriomethyl)phenyl]-3-pyridinyl]imidazo[1,2-a]pyridine;7-[2-[3-(trifluoromethyl)phenyl]-3-pyridinyl]imidazo[1,5-a]pyridine
CID 159236919

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)?
The IUPAC name of 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) (CID 158794525) is 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol).
What is the SMILES notation for 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)?
The canonical SMILES for 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) is OC(CC1CCCCC1)c1c([C@H]2C[C@H]2F)ccn2cncc12.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 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)?
The InChIKey is ISRVOORMJBVREK-ARGFFHDVSA-N. The full InChI is InChI=1S/C18H23FN2O.3C17H21FN2O/c19-15-9-14(15)13-6-7-21-11-20-10-16(21)18(13)17(22)8-12-4-2-1-3-5-12;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/h6-7,10-12,14-15,17,22H,1-5,8-9H2;3*6-7,9-11,13-14,17,21H,1-5,8H2/t14-,15-,17?;3*13-,14-,17?/m1111/s1.
What are the key properties of 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol)?
2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) has a molecular weight of 1167.49 g/mol, XLogP of 15.48, 13 rotatable bonds, 4 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol;tris(cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol) is sourced from PubChem (CID 158794525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).