1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride

C6H13ClFN — CID 146049870

IUPAC1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride
SMILESCl.NC1(CCF)CCC1
InChIInChI=1S/C6H12FN.ClH/c7-5-4-6(8)2-1-3-6;/h1-5,8H2;1H
InChIKeyISYPAYZEGWRQKJ-UHFFFAOYSA-N
MW153.63 g/mol
LogP1.65
Rot. Bonds2

About 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride

1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride (PubChem CID 146049870) has the molecular formula C6H13ClFN and a molecular weight of 153.63 g/mol. Its IUPAC name is 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride
PubChem CID146049870
Molecular FormulaC6H13ClFN
Molecular Weight153.63 g/mol
Exact Mass153.07
IUPAC Name1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride
SMILESCl.NC1(CCF)CCC1
InChIInChI=1S/C6H12FN.ClH/c7-5-4-6(8)2-1-3-6;/h1-5,8H2;1H
InChIKeyISYPAYZEGWRQKJ-UHFFFAOYSA-N
XLogP1.65
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.63
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride?
The IUPAC name of 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride (CID 146049870) is 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride.
What is the SMILES notation for 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride?
The canonical SMILES for 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride is Cl.NC1(CCF)CCC1.
What is the InChIKey of 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride?
The InChIKey is ISYPAYZEGWRQKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12FN.ClH/c7-5-4-6(8)2-1-3-6;/h1-5,8H2;1H.
What are the key properties of 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride?
1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride has a molecular weight of 153.63 g/mol, XLogP of 1.65, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoroethyl)cyclobutan-1-amine;hydrochloride is sourced from PubChem (CID 146049870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).