(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone

C10H12N2O2 — CID 63106422

IUPAC(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone
SMILESCc1cccnc1C(=O)N1CC(O)C1
InChIInChI=1S/C10H12N2O2/c1-7-3-2-4-11-9(7)10(14)12-5-8(13)6-12/h2-4,8,13H,5-6H2,1H3
InChIKeyQAHLXMAXUMDVDG-UHFFFAOYSA-N
MW192.22 g/mol
LogP0.21
Rot. Bonds1

About (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone

(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone (PubChem CID 63106422) has the molecular formula C10H12N2O2 and a molecular weight of 192.22 g/mol. Its IUPAC name is (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone.

Molecular Properties

Compound Name(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone
PubChem CID63106422
Molecular FormulaC10H12N2O2
Molecular Weight192.22 g/mol
Exact Mass192.09
IUPAC Name(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone
SMILESCc1cccnc1C(=O)N1CC(O)C1
InChIInChI=1S/C10H12N2O2/c1-7-3-2-4-11-9(7)10(14)12-5-8(13)6-12/h2-4,8,13H,5-6H2,1H3
InChIKeyQAHLXMAXUMDVDG-UHFFFAOYSA-N
XLogP0.21
TPSA53.43 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.22
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-3-hydroxypyrrolidin-1-yl]-(3-methyl-2-pyridinyl)methanone
CID 66291772
5-methyl-1-(3-methylpyridine-2-carbonyl)piperidine-3-carboxylic acid
CID 122117858
tert-butyl N-[(3R,4R,6R)-3,6-dihydroxy-1-(3-methylpyridine-2-carbonyl)azepan-4-yl]carbamate
CID 110153642
(3-aminopyrrolidin-1-yl)-(3-methyl-2-pyridinyl)methanone;dihydrochloride
CID 119482706
(6R)-6-methyl-4-(3-methylpyridine-2-carbonyl)morpholine-2-carboxylic acid
CID 120536159
3-methyl-1-(3-methylpyridine-2-carbonyl)piperidin-4-one
CID 114499935
[(3R,4R)-3-(aminomethyl)-4-phenylpyrrolidin-1-yl]-(3-methyl-2-pyridinyl)methanone;dihydrochloride
CID 120743401
(3-methyl-2-pyridinyl)-[(2R)-2-pyridin-2-ylmorpholin-4-yl]methanone
CID 125022820
(4-methyl-3-phenylpiperazin-1-yl)-(3-methyl-2-pyridinyl)methanone
CID 110098379
3-[(3R,4R)-4-hydroxy-1-(3-methylpyridine-2-carbonyl)pyrrolidin-3-yl]oxybenzoic acid
CID 110146812
[(3S,3aS,6aR)-3-(dimethylamino)-1,1-dioxo-2,3,3a,4,6,6a-hexahydrothieno[2,3-c]pyrrol-5-yl]-(3-methyl-2-pyridinyl)methanone
CID 154819375
[(5S,6S)-6-hydroxy-1-oxa-8-azaspiro[4.5]decan-8-yl]-(3-methyl-2-pyridinyl)methanone
CID 110156165

Frequently Asked Questions

What is the IUPAC name of (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone?
The IUPAC name of (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone (CID 63106422) is (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone.
What is the SMILES notation for (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone?
The canonical SMILES for (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone is Cc1cccnc1C(=O)N1CC(O)C1.
What is the InChIKey of (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone?
The InChIKey is QAHLXMAXUMDVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-7-3-2-4-11-9(7)10(14)12-5-8(13)6-12/h2-4,8,13H,5-6H2,1H3.
What are the key properties of (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone?
(3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone has a molecular weight of 192.22 g/mol, XLogP of 0.21, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-hydroxyazetidin-1-yl)-(3-methyl-2-pyridinyl)methanone is sourced from PubChem (CID 63106422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).