1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine

C12H14FNO — CID 117295877

IUPAC1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine
SMILESNC1(c2c(F)ccc3c2OCC3)CCC1
InChIInChI=1S/C12H14FNO/c13-9-3-2-8-4-7-15-11(8)10(9)12(14)5-1-6-12/h2-3H,1,4-7,14H2
InChIKeyAZMIUCLXCWZKBV-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.10
Rot. Bonds1

About 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine

1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine (PubChem CID 117295877) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine
PubChem CID117295877
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine
SMILESNC1(c2c(F)ccc3c2OCC3)CCC1
InChIInChI=1S/C12H14FNO/c13-9-3-2-8-4-7-15-11(8)10(9)12(14)5-1-6-12/h2-3H,1,4-7,14H2
InChIKeyAZMIUCLXCWZKBV-UHFFFAOYSA-N
XLogP2.10
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-fluoro-2,3-dihydro-1-benzofuran-4-yl)cyclopentan-1-amine
CID 117315938
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclopropyl]methanamine
CID 117315960
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
CID 117413291
1-(6-fluoro-3,4-dihydro-2H-1,5-benzodioxepin-9-yl)cyclopentan-1-amine
CID 117381226
1-(5-fluoro-1,3-benzodioxol-4-yl)cyclopropan-1-amine
CID 84773304
3-(1-aminocyclobutyl)-2,4-difluorophenol
CID 117288339
1-(6-fluoro-2,3-dihydro-1-benzofuran-5-yl)cyclohexan-1-amine
CID 117342628
1-(4,6-difluoro-2,3-dihydro-1-benzofuran-5-yl)cyclobutan-1-amine
CID 117322946
1-(5,7-difluoro-2,3-dihydro-1-benzofuran-4-yl)cyclopropan-1-amine
CID 117301025
(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)methanol
CID 117276567
1-(2,3-dihydro-1-benzofuran-7-yl)-2,2-dimethylcyclohexan-1-amine
CID 114743920
1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)-2-methylpropan-2-amine
CID 117298789

Frequently Asked Questions

What is the IUPAC name of 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine?
The IUPAC name of 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine (CID 117295877) is 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine.
What is the SMILES notation for 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine?
The canonical SMILES for 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine is NC1(c2c(F)ccc3c2OCC3)CCC1.
What is the InChIKey of 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine?
The InChIKey is AZMIUCLXCWZKBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c13-9-3-2-8-4-7-15-11(8)10(9)12(14)5-1-6-12/h2-3H,1,4-7,14H2.
What are the key properties of 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine?
1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine has a molecular weight of 207.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)cyclobutan-1-amine is sourced from PubChem (CID 117295877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).