2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine

C12H14FNO — CID 102653149

IUPAC2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine
SMILESCc1cccc(C(N)C2=CCCO2)c1F
InChIInChI=1S/C12H14FNO/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2,4-6,12H,3,7,14H2,1H3
InChIKeyFQMKCPGVJVBNCP-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.44
Rot. Bonds2

About 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine

2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine (PubChem CID 102653149) has the molecular formula C12H14FNO and a molecular weight of 207.25 g/mol. Its IUPAC name is 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine.

Molecular Properties

Compound Name2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine
PubChem CID102653149
Molecular FormulaC12H14FNO
Molecular Weight207.25 g/mol
Exact Mass207.11
IUPAC Name2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine
SMILESCc1cccc(C(N)C2=CCCO2)c1F
InChIInChI=1S/C12H14FNO/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2,4-6,12H,3,7,14H2,1H3
InChIKeyFQMKCPGVJVBNCP-UHFFFAOYSA-N
XLogP2.44
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,3-difluorophenyl)-(2,3-dihydrofuran-5-yl)methanol
CID 102650584
[(2-bromo-3-methylphenyl)-(2,3-dihydrofuran-5-yl)methyl]hydrazine
CID 107986221
2,3-dihydrofuran-5-yl-(2,6-dimethylphenyl)methanol
CID 102650763
(2,6-difluorophenyl)-(2-fluoro-3-methylphenyl)methanamine
CID 115859741
(2,6-dichlorophenyl)-(2,3-dihydrofuran-5-yl)methanamine
CID 102653572
2,3-dihydrofuran-5-yl-(2-fluorophenyl)methanol
CID 102650541
2,3-dihydrofuran-5-yl-(3,5-dimethylphenyl)methanamine
CID 102653132
3,4-dihydro-2H-pyran-6-yl-(2-methoxyphenyl)methanamine
CID 102647076
1-benzothiophen-3-yl(2,3-dihydrofuran-5-yl)methanamine
CID 102653017
(2-fluoro-3-methylphenyl)-(furan-3-yl)methanamine
CID 115855456
(2,5-dimethylfuran-3-yl)-(2-fluoro-3-methylphenyl)methanamine
CID 81477083
N-[2,3-dihydrofuran-5-yl-(2-iodo-3-methylphenyl)methyl]ethanamine
CID 114030284

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine?
The IUPAC name of 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine (CID 102653149) is 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine.
What is the SMILES notation for 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine?
The canonical SMILES for 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine is Cc1cccc(C(N)C2=CCCO2)c1F.
What is the InChIKey of 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine?
The InChIKey is FQMKCPGVJVBNCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14FNO/c1-8-4-2-5-9(11(8)13)12(14)10-6-3-7-15-10/h2,4-6,12H,3,7,14H2,1H3.
What are the key properties of 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine?
2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine has a molecular weight of 207.25 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydrofuran-5-yl-(2-fluoro-3-methylphenyl)methanamine is sourced from PubChem (CID 102653149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).