3-chloro-2-(3-methylazetidin-1-yl)pyridine

C9H11ClN2 — CID 103094608

IUPAC3-chloro-2-(3-methylazetidin-1-yl)pyridine
SMILESCC1CN(c2ncccc2Cl)C1
InChIInChI=1S/C9H11ClN2/c1-7-5-12(6-7)9-8(10)3-2-4-11-9/h2-4,7H,5-6H2,1H3
InChIKeyVHUYHTABVRKCMT-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.19
Rot. Bonds1

About 3-chloro-2-(3-methylazetidin-1-yl)pyridine

3-chloro-2-(3-methylazetidin-1-yl)pyridine (PubChem CID 103094608) has the molecular formula C9H11ClN2 and a molecular weight of 182.65 g/mol. Its IUPAC name is 3-chloro-2-(3-methylazetidin-1-yl)pyridine.

Molecular Properties

Compound Name3-chloro-2-(3-methylazetidin-1-yl)pyridine
PubChem CID103094608
Molecular FormulaC9H11ClN2
Molecular Weight182.65 g/mol
Exact Mass182.06
IUPAC Name3-chloro-2-(3-methylazetidin-1-yl)pyridine
SMILESCC1CN(c2ncccc2Cl)C1
InChIInChI=1S/C9H11ClN2/c1-7-5-12(6-7)9-8(10)3-2-4-11-9/h2-4,7H,5-6H2,1H3
InChIKeyVHUYHTABVRKCMT-UHFFFAOYSA-N
XLogP2.19
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-iodo-2-(3-methylazetidin-1-yl)pyridine
CID 170381224
4-(3-chloro-2-pyridinyl)-1,2-dimethylpiperazine
CID 71195511
N-[1-(3-chloro-2-pyridinyl)azetidin-3-yl]pyrimidin-2-amine
CID 121184363
2-[(3R,5S)-3,5-dimethylpiperidin-1-yl]pyridin-3-amine
CID 28845965
3-(chloromethyl)-2-(3,5-dimethylpiperidin-1-yl)pyridine
CID 61256999
[(3R,4R)-1-(3-chloro-2-pyridinyl)-4-[[(2S,6R)-2,6-dimethylmorpholin-4-yl]methyl]pyrrolidin-3-yl]methanol
CID 70713957
(3S,4S)-1-(3-chloro-2-pyridinyl)-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 122063997
3-chloro-2-[3-(triazol-1-yl)azetidin-1-yl]pyridine
CID 121183771
1-(3-chloro-2-pyridinyl)piperidin-4-amine;hydrochloride
CID 69359259
2-(3-bromopiperidin-1-yl)-3-chloropyridine
CID 80672727
2-[1-(3-chloro-2-pyridinyl)pyrrolidin-3-yl]oxy-5-methoxypyrimidine
CID 163345881
[1-(3-chloro-2-pyridinyl)-4-methylpiperidin-4-yl]methanamine
CID 107160290

Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(3-methylazetidin-1-yl)pyridine?
The IUPAC name of 3-chloro-2-(3-methylazetidin-1-yl)pyridine (CID 103094608) is 3-chloro-2-(3-methylazetidin-1-yl)pyridine.
What is the SMILES notation for 3-chloro-2-(3-methylazetidin-1-yl)pyridine?
The canonical SMILES for 3-chloro-2-(3-methylazetidin-1-yl)pyridine is CC1CN(c2ncccc2Cl)C1.
What is the InChIKey of 3-chloro-2-(3-methylazetidin-1-yl)pyridine?
The InChIKey is VHUYHTABVRKCMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2/c1-7-5-12(6-7)9-8(10)3-2-4-11-9/h2-4,7H,5-6H2,1H3.
What are the key properties of 3-chloro-2-(3-methylazetidin-1-yl)pyridine?
3-chloro-2-(3-methylazetidin-1-yl)pyridine has a molecular weight of 182.65 g/mol, XLogP of 2.19, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(3-methylazetidin-1-yl)pyridine is sourced from PubChem (CID 103094608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).