7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine

C9H10FNO — CID 43511838

IUPAC7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCNC1COc2c(F)cccc21
InChIInChI=1S/C9H10FNO/c1-11-8-5-12-9-6(8)3-2-4-7(9)10/h2-4,8,11H,5H2,1H3
InChIKeyWHQSMJCYQFFZPL-UHFFFAOYSA-N
MW167.18 g/mol
LogP1.48
Rot. Bonds1

About 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine

7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine (PubChem CID 43511838) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine.

Molecular Properties

Compound Name7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine
PubChem CID43511838
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine
SMILESCNC1COc2c(F)cccc21
InChIInChI=1S/C9H10FNO/c1-11-8-5-12-9-6(8)3-2-4-7(9)10/h2-4,8,11H,5H2,1H3
InChIKeyWHQSMJCYQFFZPL-UHFFFAOYSA-N
XLogP1.48
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(methylamino)-2,3-dihydro-1-benzofuran-7-ol
CID 112546911
7-tert-butyl-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 43512531
6-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine
CID 79982701
1-(7-fluoro-2,3-dihydro-1-benzofuran-3-yl)ethanamine
CID 83906490
(3R)-7-fluoro-3-(methoxymethyl)-2,3-dihydro-1-benzofuran
CID 58765412
N,5,7-trimethyl-2,3-dihydro-1-benzofuran-3-amine
CID 43512547
(3S)-7-fluoro-3-(methoxymethyl)-2,3-dihydro-1-benzofuran;sulfane
CID 162071384
8-fluoro-4-pyrrolidin-1-yl-3,4-dihydro-2H-chromen-3-ol
CID 82188560
(4S)-8-fluoro-4-methyl-3,4-dihydro-2H-chromene
CID 89270556
7-methyl-N-propyl-2,3-dihydro-1-benzofuran-3-amine
CID 43511879
(4S)-8-fluoro-N-[[5-(2-fluorophenyl)furan-2-yl]methyl]-3,4-dihydro-2H-chromen-4-amine
CID 166232718
7-bromo-N-methoxy-2,3-dihydro-1-benzofuran-3-amine
CID 81481939

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine?
The IUPAC name of 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine (CID 43511838) is 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine.
What is the SMILES notation for 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine?
The canonical SMILES for 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine is CNC1COc2c(F)cccc21.
What is the InChIKey of 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine?
The InChIKey is WHQSMJCYQFFZPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO/c1-11-8-5-12-9-6(8)3-2-4-7(9)10/h2-4,8,11H,5H2,1H3.
What are the key properties of 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine?
7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine has a molecular weight of 167.18 g/mol, XLogP of 1.48, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-N-methyl-2,3-dihydro-1-benzofuran-3-amine is sourced from PubChem (CID 43511838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).