(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone

C22H18F2N4O2 — CID 90298333

IUPAC(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone
SMILESO=C(c1cccc2cncn12)N1CCC(F)(F)C(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C22H18F2N4O2/c23-22(24)10-11-27(21(29)18-7-3-5-16-12-25-14-28(16)18)13-19(22)30-20-9-8-15-4-1-2-6-17(15)26-20/h1-9,12,14,19H,10-11,13H2
InChIKeyAYSZLOKFUQJLFZ-UHFFFAOYSA-N
MW408.41 g/mol
LogP3.81
Rot. Bonds3

About (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone

(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone (PubChem CID 90298333) has the molecular formula C22H18F2N4O2 and a molecular weight of 408.41 g/mol. Its IUPAC name is (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone.

Molecular Properties

Compound Name(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone
PubChem CID90298333
Molecular FormulaC22H18F2N4O2
Molecular Weight408.41 g/mol
Exact Mass408.14
IUPAC Name(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone
SMILESO=C(c1cccc2cncn12)N1CCC(F)(F)C(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C22H18F2N4O2/c23-22(24)10-11-27(21(29)18-7-3-5-16-12-25-14-28(16)18)13-19(22)30-20-9-8-15-4-1-2-6-17(15)26-20/h1-9,12,14,19H,10-11,13H2
InChIKeyAYSZLOKFUQJLFZ-UHFFFAOYSA-N
XLogP3.81
TPSA59.73 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.41
LogP ≤ 53.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone with MolForge

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Related Compounds

[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-imidazo[1,2-a]pyridin-8-ylmethanone
CID 90286489
TLX agonist 10
CID 162679531
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-(1H-pyrrolo[2,3-c]pyridin-4-yl)methanone
CID 77107393
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-[3-(1H-imidazol-2-yl)phenyl]methanone
CID 90298273
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-imidazo[1,5-a]pyridin-8-ylmethanone
CID 134144954
[6-methoxy-5-(4-methylimidazol-1-yl)pyridin-2-yl]-[(3S)-3-[2-(trifluoromethyl)phenoxy]pyrrolidin-1-yl]methanone
CID 51346977
N-imidazo[1,2-a]pyridin-6-yl-N-methyl-4-(quinolin-2-ylmethoxy)benzamide
CID 56596176
2-[3-[4-(Pyridin-4-ylmethoxy)pyrido[3,4-d]pyrimidin-2-yl]phenyl]-1,3-oxazole
CID 58578164
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-[3-(triazol-1-yl)phenyl]methanone
CID 77106400
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-(1H-pyrrolo[2,3-b]pyridin-4-yl)methanone
CID 90286316
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-(1H-pyrrolo[3,2-c]pyridin-4-yl)methanone
CID 90286327
[(3S)-4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl]-(1H-imidazo[4,5-c]pyridin-4-yl)methanone
CID 90298275

Frequently Asked Questions

What is the IUPAC name of (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone?
The IUPAC name of (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone (CID 90298333) is (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone.
What is the SMILES notation for (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone?
The canonical SMILES for (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone is O=C(c1cccc2cncn12)N1CCC(F)(F)C(Oc2ccc3ccccc3n2)C1.
What is the InChIKey of (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone?
The InChIKey is AYSZLOKFUQJLFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18F2N4O2/c23-22(24)10-11-27(21(29)18-7-3-5-16-12-25-14-28(16)18)13-19(22)30-20-9-8-15-4-1-2-6-17(15)26-20/h1-9,12,14,19H,10-11,13H2.
What are the key properties of (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone?
(4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone has a molecular weight of 408.41 g/mol, XLogP of 3.81, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4,4-difluoro-3-quinolin-2-yloxypiperidin-1-yl)-imidazo[1,5-a]pyridin-5-ylmethanone is sourced from PubChem (CID 90298333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).