3-methoxycyclobutan-1-amine

C5H11NO — CID 53302285

IUPAC3-methoxycyclobutan-1-amine
SMILESCOC1CC(N)C1
InChIInChI=1S/C5H11NO/c1-7-5-2-4(6)3-5/h4-5H,2-3,6H2,1H3
InChIKeyCTZHBPUHGUPFSN-UHFFFAOYSA-N
MW101.15 g/mol
LogP0.12
Rot. Bonds1

About 3-methoxycyclobutan-1-amine

3-methoxycyclobutan-1-amine (PubChem CID 53302285) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 3-methoxycyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxycyclobutan-1-amine
PubChem CID53302285
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name3-methoxycyclobutan-1-amine
SMILESCOC1CC(N)C1
InChIInChI=1S/C5H11NO/c1-7-5-2-4(6)3-5/h4-5H,2-3,6H2,1H3
InChIKeyCTZHBPUHGUPFSN-UHFFFAOYSA-N
XLogP0.12
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methoxycyclobutan-1-amine?
The IUPAC name of 3-methoxycyclobutan-1-amine (CID 53302285) is 3-methoxycyclobutan-1-amine.
What is the SMILES notation for 3-methoxycyclobutan-1-amine?
The canonical SMILES for 3-methoxycyclobutan-1-amine is COC1CC(N)C1.
What is the InChIKey of 3-methoxycyclobutan-1-amine?
The InChIKey is CTZHBPUHGUPFSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-7-5-2-4(6)3-5/h4-5H,2-3,6H2,1H3.
What are the key properties of 3-methoxycyclobutan-1-amine?
3-methoxycyclobutan-1-amine has a molecular weight of 101.15 g/mol, XLogP of 0.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxycyclobutan-1-amine is sourced from PubChem (CID 53302285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).