(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol

C46H48F6N6O2 — CID 159289966

IUPAC(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol
SMILESO[C@@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1
InChIInChI=1S/2C23H24F3N3O/c2*24-23(25,26)20-8-7-17(11-28-20)14-1-5-16(6-2-14)22(30)21-18(15-3-4-15)9-10-29-13-27-12-19(21)29/h2*7-16,22,30H,1-6H2/t2*14?,16?,22-/m10/s1
InChIKeyKZZILDMTFDHFDY-VVHCSGKHSA-N
MW830.92 g/mol
LogP11.27
Rot. Bonds8

About (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol

(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol (PubChem CID 159289966) has the molecular formula C46H48F6N6O2 and a molecular weight of 830.92 g/mol. Its IUPAC name is (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol.

Molecular Properties

Compound Name(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol
PubChem CID159289966
Molecular FormulaC46H48F6N6O2
Molecular Weight830.92 g/mol
Exact Mass830.37
IUPAC Name(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol
SMILESO[C@@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1
InChIInChI=1S/2C23H24F3N3O/c2*24-23(25,26)20-8-7-17(11-28-20)14-1-5-16(6-2-14)22(30)21-18(15-3-4-15)9-10-29-13-27-12-19(21)29/h2*7-16,22,30H,1-6H2/t2*14?,16?,22-/m10/s1
InChIKeyKZZILDMTFDHFDY-VVHCSGKHSA-N
XLogP11.27
TPSA100.84 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms60
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500830.92
LogP ≤ 511.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol with MolForge

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Launch Full Analysis

Related Compounds

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
2,2,2-Trifluoro-1-[3-(4-fluorophenyl)imidazo[1,5-a]pyridin-7-yl]-1-(1-methyl-1H-indol-3-yl)ethanol
CID 24959819
[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
[4-[8-amino-3-[(3R)-1-[[(1R)-2,2-difluorocyclopropyl]methyl]piperidin-3-yl]imidazo[1,5-a]pyrazin-1-yl]phenyl]-[[4-(trifluoromethyl)-2-pyridinyl]amino]methanol
CID 71235460
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
1-cyclopropyl-1-[3-(3,5-dimethylimidazol-4-yl)-6-fluoro-5-[(S)-(2-fluorophenyl)-(oxan-4-yl)methyl]pyrido[3,2-b]indol-7-yl]ethanol
CID 122675756

Frequently Asked Questions

What is the IUPAC name of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol?
The IUPAC name of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol (CID 159289966) is (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol.
What is the SMILES notation for (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol?
The canonical SMILES for (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol is O[C@@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1.O[C@H](c1c(C2CC2)ccn2cncc12)C1CCC(c2ccc(C(F)(F)F)nc2)CC1.
What is the InChIKey of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol?
The InChIKey is KZZILDMTFDHFDY-VVHCSGKHSA-N. The full InChI is InChI=1S/2C23H24F3N3O/c2*24-23(25,26)20-8-7-17(11-28-20)14-1-5-16(6-2-14)22(30)21-18(15-3-4-15)9-10-29-13-27-12-19(21)29/h2*7-16,22,30H,1-6H2/t2*14?,16?,22-/m10/s1.
What are the key properties of (S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol?
(S)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol has a molecular weight of 830.92 g/mol, XLogP of 11.27, 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)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol;(R)-(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-[4-[6-(trifluoromethyl)-3-pyridinyl]cyclohexyl]methanol is sourced from PubChem (CID 159289966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).