5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide

C11H15N3O2 — CID 23227130

IUPAC5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(OCC2CCN2)cc1C(N)=O
InChIInChI=1S/C11H15N3O2/c1-7-10(11(12)15)4-9(5-14-7)16-6-8-2-3-13-8/h4-5,8,13H,2-3,6H2,1H3,(H2,12,15)
InChIKeyXHDFKLZXBQLBIW-UHFFFAOYSA-N
MW221.26 g/mol
LogP0.23
Rot. Bonds4

About 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide

5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide (PubChem CID 23227130) has the molecular formula C11H15N3O2 and a molecular weight of 221.26 g/mol. Its IUPAC name is 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide
PubChem CID23227130
Molecular FormulaC11H15N3O2
Molecular Weight221.26 g/mol
Exact Mass221.12
IUPAC Name5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide
SMILESCc1ncc(OCC2CCN2)cc1C(N)=O
InChIInChI=1S/C11H15N3O2/c1-7-10(11(12)15)4-9(5-14-7)16-6-8-2-3-13-8/h4-5,8,13H,2-3,6H2,1H3,(H2,12,15)
InChIKeyXHDFKLZXBQLBIW-UHFFFAOYSA-N
XLogP0.23
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 50.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[(2R)-azetidin-2-yl]methoxy]-2-methylpyridin-3-amine
CID 54387024
5-[[(2S)-azetidin-2-yl]methoxy]-2,3-dimethylpyridine;hydrochloride
CID 70197125
5-[[(2S)-azetidin-2-yl]methoxy]-2-fluoropyridin-3-amine
CID 45116350
5-[[(2R)-azetidin-2-yl]methoxy]-3-bromo-2-methoxypyridine
CID 142643453
N,2-dimethyl-5-(pyrrolidin-2-ylmethoxy)pyridin-3-amine
CID 23227060
5-[1-[(2S)-azetidin-2-yl]ethoxy]-2-fluoropyridine-3-carboxamide
CID 67622655
5-(azetidin-2-ylmethoxy)-2-bromopyridine
CID 22451668
5-[[(2R)-azetidin-2-yl]methoxy]-2-chloro-3-ethynylpyridine
CID 22961844
5-[4-(hydroxymethyl)cyclohexyl]-2-methylpyridine-3-carboxamide
CID 174662247
5-(4-formylcyclohexyl)-2-methylpyridine-3-carboxamide
CID 174674045
N-[2-fluoro-5-[[(2R)-pyrrolidin-2-yl]methoxy]-3-pyridinyl]acetamide
CID 54387208
4-(pyrrolidin-2-ylmethoxy)-2-(trifluoromethyl)benzamide
CID 62347502

Frequently Asked Questions

What is the IUPAC name of 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide?
The IUPAC name of 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide (CID 23227130) is 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide.
What is the SMILES notation for 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide?
The canonical SMILES for 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide is Cc1ncc(OCC2CCN2)cc1C(N)=O.
What is the InChIKey of 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide?
The InChIKey is XHDFKLZXBQLBIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O2/c1-7-10(11(12)15)4-9(5-14-7)16-6-8-2-3-13-8/h4-5,8,13H,2-3,6H2,1H3,(H2,12,15).
What are the key properties of 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide?
5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 0.23, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(azetidin-2-ylmethoxy)-2-methylpyridine-3-carboxamide is sourced from PubChem (CID 23227130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).