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

C9H11F2N — CID 130059756

IUPAC2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine
SMILESCc1ccc(F)cc1C(N)CF
InChIInChI=1S/C9H11F2N/c1-6-2-3-7(11)4-8(6)9(12)5-10/h2-4,9H,5,12H2,1H3
InChIKeyZYYWEEWSQVYAGN-UHFFFAOYSA-N
MW171.19 g/mol
LogP2.10
Rot. Bonds2

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

2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine (PubChem CID 130059756) has the molecular formula C9H11F2N and a molecular weight of 171.19 g/mol. Its IUPAC name is 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine
PubChem CID130059756
Molecular FormulaC9H11F2N
Molecular Weight171.19 g/mol
Exact Mass171.09
IUPAC Name2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine
SMILESCc1ccc(F)cc1C(N)CF
InChIInChI=1S/C9H11F2N/c1-6-2-3-7(11)4-8(6)9(12)5-10/h2-4,9H,5,12H2,1H3
InChIKeyZYYWEEWSQVYAGN-UHFFFAOYSA-N
XLogP2.10
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.19
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(1R)-1-(5-fluoro-2-methylphenyl)ethane-1,2-diamine;hydrochloride
CID 66517054
1-(5-fluoro-2-methylphenyl)propan-1-amine;hydrochloride
CID 138110336
(1R)-3,3,3-trifluoro-1-(5-fluoro-2-methylphenyl)propan-1-amine
CID 103694276
3,3,3-trifluoro-1-(5-fluoro-2-methylphenyl)propan-1-amine
CID 62790723
(1R)-1-(5-fluoro-2-methylphenyl)pentane-1,5-diamine
CID 171204385
(1R)-1-(2-bromo-5-fluorophenyl)-2-fluoroethanamine
CID 124707188
1-(5-fluoro-2-methylphenyl)-2-methylpropan-1-amine
CID 60730207
2-(4-chloro-2-fluorophenyl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 114855471
2-(1,3-dioxolan-2-yl)-1-(5-fluoro-2-methylphenyl)ethanamine
CID 103543989
1-(5-fluoro-2-methylphenyl)-5,5-dimethylhex-3-yn-1-amine
CID 114190249
1-(5-fluoro-2-methylphenyl)-2-(4-methylphenyl)sulfanylethanamine
CID 66065190
2-fluoro-2-(5-fluoro-2-methylphenyl)ethanamine
CID 112562567

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine?
The IUPAC name of 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine (CID 130059756) is 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine.
What is the SMILES notation for 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine?
The canonical SMILES for 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine is Cc1ccc(F)cc1C(N)CF.
What is the InChIKey of 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine?
The InChIKey is ZYYWEEWSQVYAGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2N/c1-6-2-3-7(11)4-8(6)9(12)5-10/h2-4,9H,5,12H2,1H3.
What are the key properties of 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine?
2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine has a molecular weight of 171.19 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-1-(5-fluoro-2-methylphenyl)ethanamine is sourced from PubChem (CID 130059756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).