N-methoxy-3-propan-2-yloxycyclobutan-1-imine

C8H15NO2 — CID 131140593

IUPACN-methoxy-3-propan-2-yloxycyclobutan-1-imine
SMILESCON=C1CC(OC(C)C)C1
InChIInChI=1S/C8H15NO2/c1-6(2)11-8-4-7(5-8)9-10-3/h6,8H,4-5H2,1-3H3/b9-7-
InChIKeyMUFWFEDULULZBS-CLFYSBASSA-N
MW157.21 g/mol
LogP1.58
Rot. Bonds3

About N-methoxy-3-propan-2-yloxycyclobutan-1-imine

N-methoxy-3-propan-2-yloxycyclobutan-1-imine (PubChem CID 131140593) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is N-methoxy-3-propan-2-yloxycyclobutan-1-imine.

Molecular Properties

Compound NameN-methoxy-3-propan-2-yloxycyclobutan-1-imine
PubChem CID131140593
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC NameN-methoxy-3-propan-2-yloxycyclobutan-1-imine
SMILESCON=C1CC(OC(C)C)C1
InChIInChI=1S/C8H15NO2/c1-6(2)11-8-4-7(5-8)9-10-3/h6,8H,4-5H2,1-3H3/b9-7-
InChIKeyMUFWFEDULULZBS-CLFYSBASSA-N
XLogP1.58
TPSA30.82 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methoxy-3-propan-2-yloxycyclobutan-1-imine?
The IUPAC name of N-methoxy-3-propan-2-yloxycyclobutan-1-imine (CID 131140593) is N-methoxy-3-propan-2-yloxycyclobutan-1-imine.
What is the SMILES notation for N-methoxy-3-propan-2-yloxycyclobutan-1-imine?
The canonical SMILES for N-methoxy-3-propan-2-yloxycyclobutan-1-imine is CON=C1CC(OC(C)C)C1.
What is the InChIKey of N-methoxy-3-propan-2-yloxycyclobutan-1-imine?
The InChIKey is MUFWFEDULULZBS-CLFYSBASSA-N. The full InChI is InChI=1S/C8H15NO2/c1-6(2)11-8-4-7(5-8)9-10-3/h6,8H,4-5H2,1-3H3/b9-7-.
What are the key properties of N-methoxy-3-propan-2-yloxycyclobutan-1-imine?
N-methoxy-3-propan-2-yloxycyclobutan-1-imine has a molecular weight of 157.21 g/mol, XLogP of 1.58, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methoxy-3-propan-2-yloxycyclobutan-1-imine is sourced from PubChem (CID 131140593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).