1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine

C9H17NO — CID 147865054

IUPAC1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
SMILESCOCC1(CN2CCC2)CC1
InChIInChI=1S/C9H17NO/c1-11-8-9(3-4-9)7-10-5-2-6-10/h2-8H2,1H3
InChIKeyHXMIFHITMIAABT-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.12
Rot. Bonds4

About 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine

1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine (PubChem CID 147865054) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine.

Molecular Properties

Compound Name1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
PubChem CID147865054
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine
SMILESCOCC1(CN2CCC2)CC1
InChIInChI=1S/C9H17NO/c1-11-8-9(3-4-9)7-10-5-2-6-10/h2-8H2,1H3
InChIKeyHXMIFHITMIAABT-UHFFFAOYSA-N
XLogP1.12
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine?
The IUPAC name of 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine (CID 147865054) is 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine.
What is the SMILES notation for 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine?
The canonical SMILES for 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine is COCC1(CN2CCC2)CC1.
What is the InChIKey of 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine?
The InChIKey is HXMIFHITMIAABT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-11-8-9(3-4-9)7-10-5-2-6-10/h2-8H2,1H3.
What are the key properties of 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine?
1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine has a molecular weight of 155.24 g/mol, XLogP of 1.12, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(methoxymethyl)cyclopropyl]methyl]azetidine is sourced from PubChem (CID 147865054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).