3-methoxy-1,3-dipropylazetidine

C10H21NO — CID 153405283

IUPAC3-methoxy-1,3-dipropylazetidine
SMILESCCCN1CC(CCC)(OC)C1
InChIInChI=1S/C10H21NO/c1-4-6-10(12-3)8-11(9-10)7-5-2/h4-9H2,1-3H3
InChIKeyMGDIBFJINSMONV-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.90
Rot. Bonds5

About 3-methoxy-1,3-dipropylazetidine

3-methoxy-1,3-dipropylazetidine (PubChem CID 153405283) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3-methoxy-1,3-dipropylazetidine.

Molecular Properties

Compound Name3-methoxy-1,3-dipropylazetidine
PubChem CID153405283
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3-methoxy-1,3-dipropylazetidine
SMILESCCCN1CC(CCC)(OC)C1
InChIInChI=1S/C10H21NO/c1-4-6-10(12-3)8-11(9-10)7-5-2/h4-9H2,1-3H3
InChIKeyMGDIBFJINSMONV-UHFFFAOYSA-N
XLogP1.90
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1,3-dipropylazetidine?
The IUPAC name of 3-methoxy-1,3-dipropylazetidine (CID 153405283) is 3-methoxy-1,3-dipropylazetidine.
What is the SMILES notation for 3-methoxy-1,3-dipropylazetidine?
The canonical SMILES for 3-methoxy-1,3-dipropylazetidine is CCCN1CC(CCC)(OC)C1.
What is the InChIKey of 3-methoxy-1,3-dipropylazetidine?
The InChIKey is MGDIBFJINSMONV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-4-6-10(12-3)8-11(9-10)7-5-2/h4-9H2,1-3H3.
What are the key properties of 3-methoxy-1,3-dipropylazetidine?
3-methoxy-1,3-dipropylazetidine has a molecular weight of 171.28 g/mol, XLogP of 1.90, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1,3-dipropylazetidine is sourced from PubChem (CID 153405283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).