4-(azetidin-3-ylmethoxy)piperidine

C9H18N2O — CID 171641316

IUPAC4-(azetidin-3-ylmethoxy)piperidine
SMILESC1CC(OCC2CNC2)CCN1
InChIInChI=1S/C9H18N2O/c1-3-10-4-2-9(1)12-7-8-5-11-6-8/h8-11H,1-7H2
InChIKeyZBBGTUQCBDBBAQ-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.03
Rot. Bonds3

About 4-(azetidin-3-ylmethoxy)piperidine

4-(azetidin-3-ylmethoxy)piperidine (PubChem CID 171641316) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is 4-(azetidin-3-ylmethoxy)piperidine.

Molecular Properties

Compound Name4-(azetidin-3-ylmethoxy)piperidine
PubChem CID171641316
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC Name4-(azetidin-3-ylmethoxy)piperidine
SMILESC1CC(OCC2CNC2)CCN1
InChIInChI=1S/C9H18N2O/c1-3-10-4-2-9(1)12-7-8-5-11-6-8/h8-11H,1-7H2
InChIKeyZBBGTUQCBDBBAQ-UHFFFAOYSA-N
XLogP-0.03
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4R)-4-(piperidin-4-yloxymethyl)pyrrolidin-2-one
CID 124680769
3-(cyclohexylmethoxy)pyrrolidine
CID 45075453
3-(cyclobutylmethoxy)pyrrolidine;hydrochloride
CID 53409349
3-(cyclopentyloxymethyl)piperidine
CID 24693389
3-(oxetan-3-yloxymethyl)pyrrolidine
CID 115669771
4-(cyclopropylmethoxymethoxy)piperidine
CID 106937648
3-(cyclobutylmethoxy)azetidine;hydrochloride
CID 75365400
1,4-bis(cyclopropylmethoxy)cyclohexane
CID 147967519
4-[(2,2-difluoro-3,3-dimethylcyclopropyl)methoxy]piperidine
CID 126845134
4-prop-2-enoxypiperidine
CID 15172751
1-methylsulfonyl-3-(piperidin-4-yloxymethyl)piperidine
CID 79613125
4-[[(1R,2R)-2-(trifluoromethyl)cyclopropyl]methoxy]piperidine
CID 129278154

Frequently Asked Questions

What is the IUPAC name of 4-(azetidin-3-ylmethoxy)piperidine?
The IUPAC name of 4-(azetidin-3-ylmethoxy)piperidine (CID 171641316) is 4-(azetidin-3-ylmethoxy)piperidine.
What is the SMILES notation for 4-(azetidin-3-ylmethoxy)piperidine?
The canonical SMILES for 4-(azetidin-3-ylmethoxy)piperidine is C1CC(OCC2CNC2)CCN1.
What is the InChIKey of 4-(azetidin-3-ylmethoxy)piperidine?
The InChIKey is ZBBGTUQCBDBBAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-3-10-4-2-9(1)12-7-8-5-11-6-8/h8-11H,1-7H2.
What are the key properties of 4-(azetidin-3-ylmethoxy)piperidine?
4-(azetidin-3-ylmethoxy)piperidine has a molecular weight of 170.26 g/mol, XLogP of -0.03, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(azetidin-3-ylmethoxy)piperidine is sourced from PubChem (CID 171641316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).