(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol

C25H25FN4O — CID 134381374

IUPAC(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol
SMILESO[C@@H](c1c(C2CC2)ccc2cncn12)C1CCN(c2ccc(F)c3ncccc23)CC1
InChIInChI=1S/C25H25FN4O/c26-21-7-8-22(20-2-1-11-28-23(20)21)29-12-9-17(10-13-29)25(31)24-19(16-3-4-16)6-5-18-14-27-15-30(18)24/h1-2,5-8,11,14-17,25,31H,3-4,9-10,12-13H2/t25-/m1/s1
InChIKeyNXDIIESMGWBWCT-RUZDIDTESA-N
MW416.50 g/mol
LogP4.85
Rot. Bonds4

About (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol

(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol (PubChem CID 134381374) has the molecular formula C25H25FN4O and a molecular weight of 416.50 g/mol. Its IUPAC name is (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol.

Molecular Properties

Compound Name(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol
PubChem CID134381374
Molecular FormulaC25H25FN4O
Molecular Weight416.50 g/mol
Exact Mass416.20
IUPAC Name(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol
SMILESO[C@@H](c1c(C2CC2)ccc2cncn12)C1CCN(c2ccc(F)c3ncccc23)CC1
InChIInChI=1S/C25H25FN4O/c26-21-7-8-22(20-2-1-11-28-23(20)21)29-12-9-17(10-13-29)25(31)24-19(16-3-4-16)6-5-18-14-27-15-30(18)24/h1-2,5-8,11,14-17,25,31H,3-4,9-10,12-13H2/t25-/m1/s1
InChIKeyNXDIIESMGWBWCT-RUZDIDTESA-N
XLogP4.85
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.50
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol?
The IUPAC name of (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol (CID 134381374) is (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol.
What is the SMILES notation for (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol?
The canonical SMILES for (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol is O[C@@H](c1c(C2CC2)ccc2cncn12)C1CCN(c2ccc(F)c3ncccc23)CC1.
What is the InChIKey of (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol?
The InChIKey is NXDIIESMGWBWCT-RUZDIDTESA-N. The full InChI is InChI=1S/C25H25FN4O/c26-21-7-8-22(20-2-1-11-28-23(20)21)29-12-9-17(10-13-29)25(31)24-19(16-3-4-16)6-5-18-14-27-15-30(18)24/h1-2,5-8,11,14-17,25,31H,3-4,9-10,12-13H2/t25-/m1/s1.
What are the key properties of (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol?
(R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol has a molecular weight of 416.50 g/mol, XLogP of 4.85, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(6-cyclopropylimidazo[1,5-a]pyridin-5-yl)-[1-(8-fluoroquinolin-5-yl)piperidin-4-yl]methanol is sourced from PubChem (CID 134381374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).