(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol

C25H26N4O — CID 134381211

IUPAC(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol
SMILESOC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccnc3ccccc23)CC1
InChIInChI=1S/C25H26N4O/c30-25(24-19(17-5-6-17)10-14-29-16-26-15-23(24)29)18-8-12-28(13-9-18)22-7-11-27-21-4-2-1-3-20(21)22/h1-4,7,10-11,14-18,25,30H,5-6,8-9,12-13H2
InChIKeyLTIDPRPRRJDCBS-UHFFFAOYSA-N
MW398.51 g/mol
LogP4.71
Rot. Bonds4

About (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol

(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol (PubChem CID 134381211) has the molecular formula C25H26N4O and a molecular weight of 398.51 g/mol. Its IUPAC name is (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol.

Molecular Properties

Compound Name(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol
PubChem CID134381211
Molecular FormulaC25H26N4O
Molecular Weight398.51 g/mol
Exact Mass398.21
IUPAC Name(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol
SMILESOC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccnc3ccccc23)CC1
InChIInChI=1S/C25H26N4O/c30-25(24-19(17-5-6-17)10-14-29-16-26-15-23(24)29)18-8-12-28(13-9-18)22-7-11-27-21-4-2-1-3-20(21)22/h1-4,7,10-11,14-18,25,30H,5-6,8-9,12-13H2
InChIKeyLTIDPRPRRJDCBS-UHFFFAOYSA-N
XLogP4.71
TPSA53.66 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.51
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol?
The IUPAC name of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol (CID 134381211) is (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol.
What is the SMILES notation for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol?
The canonical SMILES for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol is OC(c1c(C2CC2)ccn2cncc12)C1CCN(c2ccnc3ccccc23)CC1.
What is the InChIKey of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol?
The InChIKey is LTIDPRPRRJDCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26N4O/c30-25(24-19(17-5-6-17)10-14-29-16-26-15-23(24)29)18-8-12-28(13-9-18)22-7-11-27-21-4-2-1-3-20(21)22/h1-4,7,10-11,14-18,25,30H,5-6,8-9,12-13H2.
What are the key properties of (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol?
(7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol has a molecular weight of 398.51 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (7-cyclopropylimidazo[1,5-a]pyridin-8-yl)-(1-quinolin-4-ylpiperidin-4-yl)methanol is sourced from PubChem (CID 134381211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).