2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine

C11H14FNO — CID 105426382

IUPAC2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine
SMILESCC(F)(CN)c1ccc2c(c1)OCC2
InChIInChI=1S/C11H14FNO/c1-11(12,7-13)9-3-2-8-4-5-14-10(8)6-9/h2-3,6H,4-5,7,13H2,1H3
InChIKeyOPMONRVPTINPDC-UHFFFAOYSA-N
MW195.24 g/mol
LogP1.76
Rot. Bonds2

About 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine

2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine (PubChem CID 105426382) has the molecular formula C11H14FNO and a molecular weight of 195.24 g/mol. Its IUPAC name is 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine.

Molecular Properties

Compound Name2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine
PubChem CID105426382
Molecular FormulaC11H14FNO
Molecular Weight195.24 g/mol
Exact Mass195.11
IUPAC Name2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine
SMILESCC(F)(CN)c1ccc2c(c1)OCC2
InChIInChI=1S/C11H14FNO/c1-11(12,7-13)9-3-2-8-4-5-14-10(8)6-9/h2-3,6H,4-5,7,13H2,1H3
InChIKeyOPMONRVPTINPDC-UHFFFAOYSA-N
XLogP1.76
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.24
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dihydro-1-benzofuran-6-yl)-2-methylpropan-1-amine
CID 105426380
1-amino-2-(2,3-dihydro-1-benzofuran-6-yl)propan-2-ol
CID 82401989
2-(3,4-dihydro-2H-chromen-7-yl)-2-methylpropan-1-amine
CID 105426400
6-(2-isocyanatopropan-2-yl)-2,3-dihydro-1-benzofuran
CID 105455223
6-(2,2-dimethylpropyl)-2,3-dihydro-1-benzofuran
CID 59832132
3-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbutan-1-amine
CID 22592399
methyl 2-(2,3-dihydro-1-benzofuran-6-yl)-2-methylpropanoate
CID 105475567
2-(2,3-dihydro-1-benzofuran-6-yl)ethanamine
CID 82415104
5-(trifluoromethyl)-2,3-dihydro-1-benzofuran
CID 83397414
4-(1-amino-2-fluoropropan-2-yl)benzene-1,2-diol
CID 105425989
6-ethyl-2,3-dihydro-1-benzofuran
CID 59981216
2-(3,5-dimethylphenyl)-2-fluoropropan-1-amine
CID 112565200

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine?
The IUPAC name of 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine (CID 105426382) is 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine.
What is the SMILES notation for 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine?
The canonical SMILES for 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine is CC(F)(CN)c1ccc2c(c1)OCC2.
What is the InChIKey of 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine?
The InChIKey is OPMONRVPTINPDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO/c1-11(12,7-13)9-3-2-8-4-5-14-10(8)6-9/h2-3,6H,4-5,7,13H2,1H3.
What are the key properties of 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine?
2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine has a molecular weight of 195.24 g/mol, XLogP of 1.76, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1-benzofuran-6-yl)-2-fluoropropan-1-amine is sourced from PubChem (CID 105426382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).