3-(trifluoromethoxy)cyclobutan-1-amine

C5H8F3NO — CID 146082150

IUPAC3-(trifluoromethoxy)cyclobutan-1-amine
SMILESNC1CC(OC(F)(F)F)C1
InChIInChI=1S/C5H8F3NO/c6-5(7,8)10-4-1-3(9)2-4/h3-4H,1-2,9H2
InChIKeyHBXKEGSFCNDVKS-UHFFFAOYSA-N
MW155.12 g/mol
LogP1.01
Rot. Bonds1

About 3-(trifluoromethoxy)cyclobutan-1-amine

3-(trifluoromethoxy)cyclobutan-1-amine (PubChem CID 146082150) has the molecular formula C5H8F3NO and a molecular weight of 155.12 g/mol. Its IUPAC name is 3-(trifluoromethoxy)cyclobutan-1-amine.

Molecular Properties

Compound Name3-(trifluoromethoxy)cyclobutan-1-amine
PubChem CID146082150
Molecular FormulaC5H8F3NO
Molecular Weight155.12 g/mol
Exact Mass155.06
IUPAC Name3-(trifluoromethoxy)cyclobutan-1-amine
SMILESNC1CC(OC(F)(F)F)C1
InChIInChI=1S/C5H8F3NO/c6-5(7,8)10-4-1-3(9)2-4/h3-4H,1-2,9H2
InChIKeyHBXKEGSFCNDVKS-UHFFFAOYSA-N
XLogP1.01
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.12
LogP ≤ 51.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(trifluoromethoxy)cyclobutan-1-amine?
The IUPAC name of 3-(trifluoromethoxy)cyclobutan-1-amine (CID 146082150) is 3-(trifluoromethoxy)cyclobutan-1-amine.
What is the SMILES notation for 3-(trifluoromethoxy)cyclobutan-1-amine?
The canonical SMILES for 3-(trifluoromethoxy)cyclobutan-1-amine is NC1CC(OC(F)(F)F)C1.
What is the InChIKey of 3-(trifluoromethoxy)cyclobutan-1-amine?
The InChIKey is HBXKEGSFCNDVKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8F3NO/c6-5(7,8)10-4-1-3(9)2-4/h3-4H,1-2,9H2.
What are the key properties of 3-(trifluoromethoxy)cyclobutan-1-amine?
3-(trifluoromethoxy)cyclobutan-1-amine has a molecular weight of 155.12 g/mol, XLogP of 1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(trifluoromethoxy)cyclobutan-1-amine is sourced from PubChem (CID 146082150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).