(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol

C44H48F2N6O2 — CID 159266762

IUPAC(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol
SMILESO[C@@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1
InChIInChI=1S/2C22H24FN3O/c2*23-17-2-1-3-18(12-17)25-9-6-16(7-10-25)22(27)21-19(15-4-5-15)8-11-26-14-24-13-20(21)26/h2*1-3,8,11-16,22,27H,4-7,9-10H2/t2*22-/m10/s1
InChIKeyKXEZMQHZANREEM-IKXJNKEISA-N
MW730.90 g/mol
LogP8.60
Rot. Bonds8

About (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol

(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol (PubChem CID 159266762) has the molecular formula C44H48F2N6O2 and a molecular weight of 730.90 g/mol. Its IUPAC name is (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol
PubChem CID159266762
Molecular FormulaC44H48F2N6O2
Molecular Weight730.90 g/mol
Exact Mass730.38
IUPAC Name(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol
SMILESO[C@@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1
InChIInChI=1S/2C22H24FN3O/c2*23-17-2-1-3-18(12-17)25-9-6-16(7-10-25)22(27)21-19(15-4-5-15)8-11-26-14-24-13-20(21)26/h2*1-3,8,11-16,22,27H,4-7,9-10H2/t2*22-/m10/s1
InChIKeyKXEZMQHZANREEM-IKXJNKEISA-N
XLogP8.60
TPSA81.54 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms54
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500730.90
LogP ≤ 58.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol with MolForge

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Related Compounds

US11420970, Example 215
CID 156073464
1-[4-[Hydroxy(diphenyl)methyl]piperidin-1-yl]-3-(6-pyrrol-1-ylpurin-9-yl)propan-2-ol
CID 10097785
3-[3-[2,2,2-Trifluoro-1-[3-(4-fluorophenyl)imidazo[1,5-a]pyridin-7-yl]-1-hydroxyethyl]indol-1-yl]propane-1,2-diol
CID 24959458
[6-(N-(6-cyclopropyl-3-pyridinyl)anilino)-2-fluoro-3-pyridinyl]-[4-cyclopropyl-7-tri(propan-2-yl)silylpyrrolo[2,3-d]pyrimidin-5-yl]methanol
CID 67460377
[6-(2-cyclopropyl-N-pyridin-3-ylanilino)-2-fluoro-3-pyridinyl]-[4-cyclopropyl-7-tri(propan-2-yl)silylpyrrolo[2,3-d]pyrimidin-5-yl]methanol
CID 67460379
2-[14-(Fluoromethyl)-6,10,13,15-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),11,13,15-tetraen-10-yl]-1-(5-fluoro-2-pyridinyl)ethanol
CID 71007686
2-cyclohexyl-1-[7-[(1S,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol
CID 122604975
cyclohexyl-[7-[(1S,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol
CID 122605044
cyclohexyl-[7-[(1R,2S)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol
CID 122609308
cyclohexyl-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]methanol
CID 122609310
2-cyclohexyl-1-[7-[(1R,2R)-2-fluorocyclopropyl]imidazo[1,5-a]pyridin-8-yl]ethanol
CID 122609314
Cyclohexyl-[7-(trifluoromethyl)imidazo[1,5-a]pyridin-8-yl]methanol
CID 122609353

Frequently Asked Questions

What is the IUPAC name of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol?
The IUPAC name of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol (CID 159266762) is (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol.
What is the SMILES notation for (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol?
The canonical SMILES for (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol is O[C@@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCN(c2cccc(F)c2)CC1.
What is the InChIKey of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol?
The InChIKey is KXEZMQHZANREEM-IKXJNKEISA-N. The full InChI is InChI=1S/2C22H24FN3O/c2*23-17-2-1-3-18(12-17)25-9-6-16(7-10-25)22(27)21-19(15-4-5-15)8-11-26-14-24-13-20(21)26/h2*1-3,8,11-16,22,27H,4-7,9-10H2/t2*22-/m10/s1.
What are the key properties of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol?
(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol has a molecular weight of 730.90 g/mol, XLogP of 8.60, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[1-(3-fluorophenyl)piperidin-4-yl]methanol is sourced from PubChem (CID 159266762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).