(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine

C11H14FNO — CID 131499914

IUPAC(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine
SMILESN[C@H](CCF)c1ccc2c(c1)CCO2
InChIInChI=1S/C11H14FNO/c12-5-3-10(13)8-1-2-11-9(7-8)4-6-14-11/h1-2,7,10H,3-6,13H2/t10-/m1/s1
InChIKeySDHFFOHCMJWMJJ-SNVBAGLBSA-N
MW195.24 g/mol
LogP1.98
Rot. Bonds3

About (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine

(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine (PubChem CID 131499914) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine.

Molecular Properties

Compound Name(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine
PubChem CID131499914
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine
SMILESN[C@H](CCF)c1ccc2c(c1)CCO2
InChIInChI=1S/C11H14FNO/c12-5-3-10(13)8-1-2-11-9(7-8)4-6-14-11/h1-2,7,10H,3-6,13H2/t10-/m1/s1
InChIKeySDHFFOHCMJWMJJ-SNVBAGLBSA-N
XLogP1.98
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-(2,3-dihydro-1-benzofuran-5-yl)-2-fluoroethanamine;hydrochloride
CID 171202474
1-(2,3-dihydro-1-benzofuran-5-yl)pentan-1-amine;hydrochloride
CID 86262922
(2R)-2-amino-2-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 66513598
4-amino-4-(2,3-dihydro-1-benzofuran-5-yl)butanenitrile
CID 116940064
6-amino-6-(2,3-dihydro-1-benzofuran-5-yl)hexanamide
CID 54927378
(4R)-4-amino-4-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid
CID 28744449
4-amino-4-(2,3-dihydro-1-benzofuran-5-yl)butanoic acid
CID 43209176
(1S)-1-(2,3-dihydro-1-benzofuran-5-yl)-4-phenylbutan-1-amine
CID 794253
1-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbutan-1-amine;hydrochloride
CID 86262999
(1R)-2-cyclopropyl-1-(2,3-dihydro-1-benzofuran-5-yl)ethanamine;hydrochloride
CID 171202488
1-(2,3-dihydro-1-benzofuran-5-yl)-3-piperazin-1-ylpropan-1-amine
CID 116939919
5-amino-5-(3,4-dihydro-2H-chromen-6-yl)pentanamide
CID 54907654

Frequently Asked Questions

What is the IUPAC name of (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine?
The IUPAC name of (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine (CID 131499914) is (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine.
What is the SMILES notation for (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine?
The canonical SMILES for (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine is N[C@H](CCF)c1ccc2c(c1)CCO2.
What is the InChIKey of (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine?
The InChIKey is SDHFFOHCMJWMJJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14FNO/c12-5-3-10(13)8-1-2-11-9(7-8)4-6-14-11/h1-2,7,10H,3-6,13H2/t10-/m1/s1.
What are the key properties of (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine?
(1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine has a molecular weight of 195.24 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-(2,3-dihydro-1-benzofuran-5-yl)-3-fluoropropan-1-amine is sourced from PubChem (CID 131499914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).