[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone

C21H21N3O2 — CID 90566268

IUPAC[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone
SMILESCc1ccc(OC2CCN(C(=O)c3ccc4ccccc4n3)CC2)cn1
InChIInChI=1S/C21H21N3O2/c1-15-6-8-18(14-22-15)26-17-10-12-24(13-11-17)21(25)20-9-7-16-4-2-3-5-19(16)23-20/h2-9,14,17H,10-13H2,1H3
InChIKeyAKERDCFEIIAQOB-UHFFFAOYSA-N
MW347.42 g/mol
LogP3.62
Rot. Bonds3

About [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone

[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone (PubChem CID 90566268) has the molecular formula C21H21N3O2 and a molecular weight of 347.42 g/mol. Its IUPAC name is [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone.

Molecular Properties

Compound Name[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone
PubChem CID90566268
Molecular FormulaC21H21N3O2
Molecular Weight347.42 g/mol
Exact Mass347.16
IUPAC Name[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone
SMILESCc1ccc(OC2CCN(C(=O)c3ccc4ccccc4n3)CC2)cn1
InChIInChI=1S/C21H21N3O2/c1-15-6-8-18(14-22-15)26-17-10-12-24(13-11-17)21(25)20-9-7-16-4-2-3-5-19(16)23-20/h2-9,14,17H,10-13H2,1H3
InChIKeyAKERDCFEIIAQOB-UHFFFAOYSA-N
XLogP3.62
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.42
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

quinolin-2-yl-(4-quinoxalin-2-yloxypiperidin-1-yl)methanone
CID 90559814
(2-fluorophenyl)-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566330
6-methyl-4-[1-(quinoline-2-carbonyl)pyrrolidin-3-yl]oxypyran-2-one
CID 90628747
[4-(4-pyridin-4-yloxypiperidin-1-yl)piperidin-1-yl]-quinolin-2-ylmethanone
CID 90617379
(5-cyclopropyl-1,2-oxazol-3-yl)-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566485
(3,4-dimethylphenyl)-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566313
(5-bromofuran-2-yl)-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566406
(4-methylsulfonylpiperidin-1-yl)-quinolin-2-ylmethanone
CID 90586527
[4-(chloromethyl)piperidin-1-yl]-quinolin-2-ylmethanone
CID 63398231
2,1,3-benzothiadiazol-5-yl-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566474
(2-methyl-2,3-dihydro-1,4-benzodioxin-3-yl)-[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]methanone
CID 90566437
5-[4-[(6-methyl-3-pyridinyl)oxy]piperidine-1-carbonyl]pyran-2-one
CID 90566440

Frequently Asked Questions

What is the IUPAC name of [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone?
The IUPAC name of [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone (CID 90566268) is [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone.
What is the SMILES notation for [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone?
The canonical SMILES for [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone is Cc1ccc(OC2CCN(C(=O)c3ccc4ccccc4n3)CC2)cn1.
What is the InChIKey of [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone?
The InChIKey is AKERDCFEIIAQOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H21N3O2/c1-15-6-8-18(14-22-15)26-17-10-12-24(13-11-17)21(25)20-9-7-16-4-2-3-5-19(16)23-20/h2-9,14,17H,10-13H2,1H3.
What are the key properties of [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone?
[4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone has a molecular weight of 347.42 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(6-methyl-3-pyridinyl)oxy]piperidin-1-yl]-quinolin-2-ylmethanone is sourced from PubChem (CID 90566268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).