1-(2-fluoro-5-methylphenyl)ethenamine

C9H10FN — CID 58593408

IUPAC1-(2-fluoro-5-methylphenyl)ethenamine
SMILESC=C(N)c1cc(C)ccc1F
InChIInChI=1S/C9H10FN/c1-6-3-4-9(10)8(5-6)7(2)11/h3-5H,2,11H2,1H3
InChIKeyRHVMUHSPSBAJHB-UHFFFAOYSA-N
MW151.18 g/mol
LogP2.06
Rot. Bonds1

About 1-(2-fluoro-5-methylphenyl)ethenamine

1-(2-fluoro-5-methylphenyl)ethenamine (PubChem CID 58593408) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is 1-(2-fluoro-5-methylphenyl)ethenamine.

Molecular Properties

Compound Name1-(2-fluoro-5-methylphenyl)ethenamine
PubChem CID58593408
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name1-(2-fluoro-5-methylphenyl)ethenamine
SMILESC=C(N)c1cc(C)ccc1F
InChIInChI=1S/C9H10FN/c1-6-3-4-9(10)8(5-6)7(2)11/h3-5H,2,11H2,1H3
InChIKeyRHVMUHSPSBAJHB-UHFFFAOYSA-N
XLogP2.06
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-fluoro-5-methylphenyl)ethenamine?
The IUPAC name of 1-(2-fluoro-5-methylphenyl)ethenamine (CID 58593408) is 1-(2-fluoro-5-methylphenyl)ethenamine.
What is the SMILES notation for 1-(2-fluoro-5-methylphenyl)ethenamine?
The canonical SMILES for 1-(2-fluoro-5-methylphenyl)ethenamine is C=C(N)c1cc(C)ccc1F.
What is the InChIKey of 1-(2-fluoro-5-methylphenyl)ethenamine?
The InChIKey is RHVMUHSPSBAJHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c1-6-3-4-9(10)8(5-6)7(2)11/h3-5H,2,11H2,1H3.
What are the key properties of 1-(2-fluoro-5-methylphenyl)ethenamine?
1-(2-fluoro-5-methylphenyl)ethenamine has a molecular weight of 151.18 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluoro-5-methylphenyl)ethenamine is sourced from PubChem (CID 58593408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).