3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine

C10H11F4N — CID 103759864

IUPAC3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine
SMILESCNC(Cc1ccc(F)cc1F)C(F)F
InChIInChI=1S/C10H11F4N/c1-15-9(10(13)14)4-6-2-3-7(11)5-8(6)12/h2-3,5,9-10,15H,4H2,1H3
InChIKeyFQMDDXGNLKWYSJ-UHFFFAOYSA-N
MW221.20 g/mol
LogP2.36
Rot. Bonds4

About 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine

3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine (PubChem CID 103759864) has the molecular formula C10H11F4N and a molecular weight of 221.20 g/mol. Its IUPAC name is 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine.

Molecular Properties

Compound Name3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine
PubChem CID103759864
Molecular FormulaC10H11F4N
Molecular Weight221.20 g/mol
Exact Mass221.08
IUPAC Name3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine
SMILESCNC(Cc1ccc(F)cc1F)C(F)F
InChIInChI=1S/C10H11F4N/c1-15-9(10(13)14)4-6-2-3-7(11)5-8(6)12/h2-3,5,9-10,15H,4H2,1H3
InChIKeyFQMDDXGNLKWYSJ-UHFFFAOYSA-N
XLogP2.36
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.20
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-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

2-(2,4-difluorophenyl)-1-(2,6-difluorophenyl)-N-methylethanamine
CID 64561397
1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine
CID 62196245
1-(2,4-difluorophenyl)-3-(2,6-difluorophenyl)-N-methylpropan-2-amine
CID 114932067
1-cyclobutyl-2-(2,4-difluorophenyl)-N-methylethanamine
CID 64986277
1-(2,4-difluorophenyl)-N-methyl-4-methylsulfanylbutan-2-amine
CID 105117577
1,3-bis(2,4-difluorophenyl)propan-2-amine
CID 64561196
1-(2,4-difluorophenyl)propan-2-amine;hydrochloride
CID 155973682
1-(2,4-difluorophenyl)butan-2-ol
CID 23056492
1-(2,4-difluorophenyl)-N-methylundecan-2-amine
CID 64560625
3-(2,4-difluorophenyl)-1,1-diethoxy-N-ethylpropan-2-amine
CID 79496290
1-(2,6-difluoro-3-methylphenyl)-2-(2,4-difluorophenyl)-N-methylethanamine
CID 82798424
1-(4-chloro-2-fluorophenyl)-2-(2,4-difluorophenyl)-N-methylethanamine
CID 63081771

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine?
The IUPAC name of 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine (CID 103759864) is 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine.
What is the SMILES notation for 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine?
The canonical SMILES for 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine is CNC(Cc1ccc(F)cc1F)C(F)F.
What is the InChIKey of 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine?
The InChIKey is FQMDDXGNLKWYSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F4N/c1-15-9(10(13)14)4-6-2-3-7(11)5-8(6)12/h2-3,5,9-10,15H,4H2,1H3.
What are the key properties of 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine?
3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine has a molecular weight of 221.20 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-difluorophenyl)-1,1-difluoro-N-methylpropan-2-amine is sourced from PubChem (CID 103759864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).