2-(1-methoxycyclopentyl)azetidine

C9H17NO — CID 131187770

IUPAC2-(1-methoxycyclopentyl)azetidine
SMILESCOC1(C2CCN2)CCCC1
InChIInChI=1S/C9H17NO/c1-11-9(5-2-3-6-9)8-4-7-10-8/h8,10H,2-7H2,1H3
InChIKeyYGCVTRRRRLGIII-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.31
Rot. Bonds2

About 2-(1-methoxycyclopentyl)azetidine

2-(1-methoxycyclopentyl)azetidine (PubChem CID 131187770) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-(1-methoxycyclopentyl)azetidine.

Molecular Properties

Compound Name2-(1-methoxycyclopentyl)azetidine
PubChem CID131187770
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-(1-methoxycyclopentyl)azetidine
SMILESCOC1(C2CCN2)CCCC1
InChIInChI=1S/C9H17NO/c1-11-9(5-2-3-6-9)8-4-7-10-8/h8,10H,2-7H2,1H3
InChIKeyYGCVTRRRRLGIII-UHFFFAOYSA-N
XLogP1.31
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-methoxycyclopentyl)azetidine?
The IUPAC name of 2-(1-methoxycyclopentyl)azetidine (CID 131187770) is 2-(1-methoxycyclopentyl)azetidine.
What is the SMILES notation for 2-(1-methoxycyclopentyl)azetidine?
The canonical SMILES for 2-(1-methoxycyclopentyl)azetidine is COC1(C2CCN2)CCCC1.
What is the InChIKey of 2-(1-methoxycyclopentyl)azetidine?
The InChIKey is YGCVTRRRRLGIII-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-11-9(5-2-3-6-9)8-4-7-10-8/h8,10H,2-7H2,1H3.
What are the key properties of 2-(1-methoxycyclopentyl)azetidine?
2-(1-methoxycyclopentyl)azetidine has a molecular weight of 155.24 g/mol, XLogP of 1.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-methoxycyclopentyl)azetidine is sourced from PubChem (CID 131187770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).