pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone

C18H15N3O2 — CID 122250415

IUPACpyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone
SMILESO=C(c1cccnc1)N1CC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C18H15N3O2/c22-18(14-5-3-9-19-10-14)21-11-15(12-21)23-17-8-7-13-4-1-2-6-16(13)20-17/h1-10,15H,11-12H2
InChIKeyOBFJMJUEVKZLDH-UHFFFAOYSA-N
MW305.34 g/mol
LogP2.53
Rot. Bonds3

About pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone

pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone (PubChem CID 122250415) has the molecular formula C18H15N3O2 and a molecular weight of 305.34 g/mol. Its IUPAC name is pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone.

Molecular Properties

Compound Namepyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone
PubChem CID122250415
Molecular FormulaC18H15N3O2
Molecular Weight305.34 g/mol
Exact Mass305.12
IUPAC Namepyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone
SMILESO=C(c1cccnc1)N1CC(Oc2ccc3ccccc3n2)C1
InChIInChI=1S/C18H15N3O2/c22-18(14-5-3-9-19-10-14)21-11-15(12-21)23-17-8-7-13-4-1-2-6-16(13)20-17/h1-10,15H,11-12H2
InChIKeyOBFJMJUEVKZLDH-UHFFFAOYSA-N
XLogP2.53
TPSA55.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.34
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(4-methoxyphenyl)-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250286
1,2-oxazol-5-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250187
(2-fluorophenyl)-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250299
(3-quinolin-2-yloxyazetidin-1-yl)-[3-(tetrazol-1-yl)phenyl]methanone
CID 122250188
1H-indol-2-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250203
3-chloro-1-(3-quinolin-2-yloxyazetidin-1-yl)propan-1-one
CID 122250273
(5-bromo-2-chlorophenyl)-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250314
pyridin-3-yl-(4-quinolin-2-ylpiperazin-1-yl)methanone;hydrochloride
CID 3030200
(4-methylpiperazin-1-yl)-(3-quinolin-2-yloxyazetidin-1-yl)methanone
CID 122250593
(3-hydroxyazetidin-1-yl)-pyridin-3-ylmethanone
CID 63106557
pyridin-2-yl-(3-quinolin-2-yloxypyrrolidin-1-yl)methanone
CID 91815849
4-(3-quinolin-2-yloxypyrrolidine-1-carbonyl)benzonitrile
CID 91815852

Frequently Asked Questions

What is the IUPAC name of pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone?
The IUPAC name of pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone (CID 122250415) is pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone.
What is the SMILES notation for pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone?
The canonical SMILES for pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone is O=C(c1cccnc1)N1CC(Oc2ccc3ccccc3n2)C1.
What is the InChIKey of pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone?
The InChIKey is OBFJMJUEVKZLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O2/c22-18(14-5-3-9-19-10-14)21-11-15(12-21)23-17-8-7-13-4-1-2-6-16(13)20-17/h1-10,15H,11-12H2.
What are the key properties of pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone?
pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone has a molecular weight of 305.34 g/mol, XLogP of 2.53, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-yl-(3-quinolin-2-yloxyazetidin-1-yl)methanone is sourced from PubChem (CID 122250415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).