1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine

C16H17F2N — CID 114931214

IUPAC1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine
SMILESCc1ccccc1C(C)(N)Cc1c(F)cccc1F
InChIInChI=1S/C16H17F2N/c1-11-6-3-4-7-13(11)16(2,19)10-12-14(17)8-5-9-15(12)18/h3-9H,10,19H2,1-2H3
InChIKeyHLTDACPFKXXSGC-UHFFFAOYSA-N
MW261.31 g/mol
LogP3.69
Rot. Bonds3

About 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine

1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine (PubChem CID 114931214) has the molecular formula C16H17F2N and a molecular weight of 261.31 g/mol. Its IUPAC name is 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine.

Molecular Properties

Compound Name1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine
PubChem CID114931214
Molecular FormulaC16H17F2N
Molecular Weight261.31 g/mol
Exact Mass261.13
IUPAC Name1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine
SMILESCc1ccccc1C(C)(N)Cc1c(F)cccc1F
InChIInChI=1S/C16H17F2N/c1-11-6-3-4-7-13(11)16(2,19)10-12-14(17)8-5-9-15(12)18/h3-9H,10,19H2,1-2H3
InChIKeyHLTDACPFKXXSGC-UHFFFAOYSA-N
XLogP3.69
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.31
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine 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

1-Phenylcyclohexylamine
CID 31862
Cyclohexanamine, 1-phenyl-, hydrochloride (1:1)
CID 200391
Tritylamine
CID 138598
(2R)-3,3-bis(3-fluorophenyl)-2-methylpropan-1-amine
CID 9860006
1-(4-Fluorophenyl)cyclohexan-1-amine
CID 24274287
1-(3-Fluorophenyl)cyclohexan-1-amine hydrochloride
CID 45259864
1-(p-Fluorophenyl)-N-methylcyclohexylamine
CID 97168
1-(3-Methylphenyl)cyclohexan-1-amine hydrochloride
CID 45259751
3-Phenylpentan-3-amine hydrochloride
CID 45036910
Cumylamine
CID 68509
(4'-Fluoro[1,1'-biphenyl]-2-YL)methanamine
CID 3770185
1-(3-Fluorophenyl)cyclohexylamine
CID 3035993

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine?
The IUPAC name of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine (CID 114931214) is 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine.
What is the SMILES notation for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine?
The canonical SMILES for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine is Cc1ccccc1C(C)(N)Cc1c(F)cccc1F.
What is the InChIKey of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine?
The InChIKey is HLTDACPFKXXSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17F2N/c1-11-6-3-4-7-13(11)16(2,19)10-12-14(17)8-5-9-15(12)18/h3-9H,10,19H2,1-2H3.
What are the key properties of 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine?
1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine has a molecular weight of 261.31 g/mol, XLogP of 3.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-difluorophenyl)-2-(2-methylphenyl)propan-2-amine is sourced from PubChem (CID 114931214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).