3-(1-propan-2-ylazetidin-3-yl)pyridine

C11H16N2 — CID 58547303

IUPAC3-(1-propan-2-ylazetidin-3-yl)pyridine
SMILESCC(C)N1CC(c2cccnc2)C1
InChIInChI=1S/C11H16N2/c1-9(2)13-7-11(8-13)10-4-3-5-12-6-10/h3-6,9,11H,7-8H2,1-2H3
InChIKeyMZAYFBXWHIJQQK-UHFFFAOYSA-N
MW176.26 g/mol
LogP1.89
Rot. Bonds2

About 3-(1-propan-2-ylazetidin-3-yl)pyridine

3-(1-propan-2-ylazetidin-3-yl)pyridine (PubChem CID 58547303) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is 3-(1-propan-2-ylazetidin-3-yl)pyridine.

Molecular Properties

Compound Name3-(1-propan-2-ylazetidin-3-yl)pyridine
PubChem CID58547303
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name3-(1-propan-2-ylazetidin-3-yl)pyridine
SMILESCC(C)N1CC(c2cccnc2)C1
InChIInChI=1S/C11H16N2/c1-9(2)13-7-11(8-13)10-4-3-5-12-6-10/h3-6,9,11H,7-8H2,1-2H3
InChIKeyMZAYFBXWHIJQQK-UHFFFAOYSA-N
XLogP1.89
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 51.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-phenyl-1-propan-2-ylazetidine
CID 23628
3-(1-methylsulfanylazetidin-3-yl)pyridine
CID 166936093
3-(1-methylpiperidin-3-yl)pyridine
CID 118883076
5-(1-propan-2-ylazetidin-3-yl)pyridin-2-amine
CID 137417873
3-chloro-5-(1-propan-2-ylazetidin-3-yl)pyridine
CID 166469655
3-(3-methoxyphenyl)-1-propan-2-ylazetidine
CID 166469184
3-[3-(3,5-dipyridin-3-ylcyclohexyl)-5-pyridin-3-ylcyclohexyl]pyridine
CID 58652188
amino-(4-pyridin-3-ylpiperidin-1-yl)methanol
CID 145342112
(2R,4R,6R)-1,6-dimethyl-4-pyridin-3-ylpiperidin-2-ol
CID 125449895
3-[(1S,2R)-2-propan-2-ylcyclopropyl]pyridine
CID 167340168
(1S,5R)-3-propan-2-yl-6-[(4-pyridin-3-ylphenoxy)methyl]-3-azabicyclo[3.1.0]hexane
CID 143585968
2-naphthalen-2-yloxy-1-(3-pyridin-3-ylazetidin-1-yl)propan-1-one
CID 70777350

Frequently Asked Questions

What is the IUPAC name of 3-(1-propan-2-ylazetidin-3-yl)pyridine?
The IUPAC name of 3-(1-propan-2-ylazetidin-3-yl)pyridine (CID 58547303) is 3-(1-propan-2-ylazetidin-3-yl)pyridine.
What is the SMILES notation for 3-(1-propan-2-ylazetidin-3-yl)pyridine?
The canonical SMILES for 3-(1-propan-2-ylazetidin-3-yl)pyridine is CC(C)N1CC(c2cccnc2)C1.
What is the InChIKey of 3-(1-propan-2-ylazetidin-3-yl)pyridine?
The InChIKey is MZAYFBXWHIJQQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2/c1-9(2)13-7-11(8-13)10-4-3-5-12-6-10/h3-6,9,11H,7-8H2,1-2H3.
What are the key properties of 3-(1-propan-2-ylazetidin-3-yl)pyridine?
3-(1-propan-2-ylazetidin-3-yl)pyridine has a molecular weight of 176.26 g/mol, XLogP of 1.89, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-propan-2-ylazetidin-3-yl)pyridine is sourced from PubChem (CID 58547303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).