1-(3-fluoro-4-methylphenyl)ethenamine

C9H10FN — CID 129060192

IUPAC1-(3-fluoro-4-methylphenyl)ethenamine
SMILESC=C(N)c1ccc(C)c(F)c1
InChIInChI=1S/C9H10FN/c1-6-3-4-8(7(2)11)5-9(6)10/h3-5H,2,11H2,1H3
InChIKeyBGNMDWJUPUAFSC-UHFFFAOYSA-N
MW151.18 g/mol
LogP2.06
Rot. Bonds1

About 1-(3-fluoro-4-methylphenyl)ethenamine

1-(3-fluoro-4-methylphenyl)ethenamine (PubChem CID 129060192) has the molecular formula C9H10FN and a molecular weight of 151.18 g/mol. Its IUPAC name is 1-(3-fluoro-4-methylphenyl)ethenamine.

Molecular Properties

Compound Name1-(3-fluoro-4-methylphenyl)ethenamine
PubChem CID129060192
Molecular FormulaC9H10FN
Molecular Weight151.18 g/mol
Exact Mass151.08
IUPAC Name1-(3-fluoro-4-methylphenyl)ethenamine
SMILESC=C(N)c1ccc(C)c(F)c1
InChIInChI=1S/C9H10FN/c1-6-3-4-8(7(2)11)5-9(6)10/h3-5H,2,11H2,1H3
InChIKeyBGNMDWJUPUAFSC-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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Related Compounds

(E)-2,3-bis(3-fluoro-4-methylphenyl)but-2-enediamide
CID 71246699
(1E)-2-(3-fluoro-4-methylphenyl)-N,N-dimethylbuta-1,3-dien-1-amine
CID 176970067
2,2,2-trifluoro-1-(3-fluoro-4-methylphenyl)ethanone
CID 2759044
3-fluoro-4-methyl-N-oxobenzamide
CID 126760596
(3-fluoro-4-methylphenyl)-(2,4,6-trimethylphenyl)methanone
CID 43337574
1-(3-fluoro-4-methylphenyl)-2-propylpentan-1-one
CID 107129986
N-(2-amino-6-fluorophenyl)-3-fluoro-4-methylbenzamide
CID 81315291
2-(3,4-dimethylphenyl)prop-2-enamide
CID 69495371
N-amino-N'-tert-butyl-3-fluoro-4-methylbenzenecarboximidamide
CID 61360497
3,3,3-trifluoro-1-(3-fluoro-4-methylphenyl)-2-(trifluoromethyl)propan-1-one
CID 107129942
2-fluoro-1-methyl-4-[1-(4-methylphenyl)prop-1-en-2-yl]benzene
CID 71053887
(2,5-dimethylphenyl)-(3-fluoro-4-methylphenyl)methanone
CID 43337276

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methylphenyl)ethenamine?
The IUPAC name of 1-(3-fluoro-4-methylphenyl)ethenamine (CID 129060192) is 1-(3-fluoro-4-methylphenyl)ethenamine.
What is the SMILES notation for 1-(3-fluoro-4-methylphenyl)ethenamine?
The canonical SMILES for 1-(3-fluoro-4-methylphenyl)ethenamine is C=C(N)c1ccc(C)c(F)c1.
What is the InChIKey of 1-(3-fluoro-4-methylphenyl)ethenamine?
The InChIKey is BGNMDWJUPUAFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN/c1-6-3-4-8(7(2)11)5-9(6)10/h3-5H,2,11H2,1H3.
What are the key properties of 1-(3-fluoro-4-methylphenyl)ethenamine?
1-(3-fluoro-4-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-(3-fluoro-4-methylphenyl)ethenamine is sourced from PubChem (CID 129060192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).