1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride

C11H15ClFN — CID 86277096

IUPAC1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride
SMILESCl.NC1(Cc2ccc(F)cc2)CCC1
InChIInChI=1S/C11H14FN.ClH/c12-10-4-2-9(3-5-10)8-11(13)6-1-7-11;/h2-5H,1,6-8,13H2;1H
InChIKeyGNZCPFJFHXXKAT-UHFFFAOYSA-N
MW215.70 g/mol
LogP2.67
Rot. Bonds2

About 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride

1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride (PubChem CID 86277096) has the molecular formula C11H15ClFN and a molecular weight of 215.70 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride
PubChem CID86277096
Molecular FormulaC11H15ClFN
Molecular Weight215.70 g/mol
Exact Mass215.09
IUPAC Name1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride
SMILESCl.NC1(Cc2ccc(F)cc2)CCC1
InChIInChI=1S/C11H14FN.ClH/c12-10-4-2-9(3-5-10)8-11(13)6-1-7-11;/h2-5H,1,6-8,13H2;1H
InChIKeyGNZCPFJFHXXKAT-UHFFFAOYSA-N
XLogP2.67
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.70
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 60798898
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1-[(4-bromophenyl)methyl]cyclopentan-1-amine
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CID 64516010
1-[(4-bromophenyl)methyl]cyclooctan-1-amine
CID 80603993
1-[2-(4-fluorophenyl)ethyl]cyclopropan-1-amine
CID 67420694
1-[2-[(4-fluorophenyl)methyl-methylamino]ethyl]cyclopentan-1-amine
CID 64679516
1-(1-aminocyclobutyl)-2-(4-fluorophenyl)ethanone
CID 116598390
1-[(4-iodophenyl)methyl]cyclopropan-1-amine
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4-[(4-chlorophenyl)methyl]piperidin-4-amine;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride?
The IUPAC name of 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride (CID 86277096) is 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride is Cl.NC1(Cc2ccc(F)cc2)CCC1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride?
The InChIKey is GNZCPFJFHXXKAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FN.ClH/c12-10-4-2-9(3-5-10)8-11(13)6-1-7-11;/h2-5H,1,6-8,13H2;1H.
What are the key properties of 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride?
1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride has a molecular weight of 215.70 g/mol, XLogP of 2.67, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]cyclobutan-1-amine;hydrochloride is sourced from PubChem (CID 86277096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).