1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine

C12H15F2N — CID 62196245

IUPAC1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C12H15F2N/c1-15-12(8-2-3-8)6-9-4-5-10(13)7-11(9)14/h4-5,7-8,12,15H,2-3,6H2,1H3
InChIKeyGFRQXACGNUJSPI-UHFFFAOYSA-N
MW211.25 g/mol
LogP2.51
Rot. Bonds4

About 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine

1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine (PubChem CID 62196245) has the molecular formula C12H15F2N and a molecular weight of 211.25 g/mol. Its IUPAC name is 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine
PubChem CID62196245
Molecular FormulaC12H15F2N
Molecular Weight211.25 g/mol
Exact Mass211.12
IUPAC Name1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(F)cc1F)C1CC1
InChIInChI=1S/C12H15F2N/c1-15-12(8-2-3-8)6-9-4-5-10(13)7-11(9)14/h4-5,7-8,12,15H,2-3,6H2,1H3
InChIKeyGFRQXACGNUJSPI-UHFFFAOYSA-N
XLogP2.51
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.25
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-cyclobutyl-2-(2,4-difluorophenyl)-N-methylethanamine
CID 64986277
2-(2,4-difluorophenyl)-N-methyl-1-(oxan-4-yl)ethanamine
CID 64561011
2-(2,4-difluorophenyl)-1-(3,4-dimethylcyclohexyl)-N-methylethanamine
CID 64740451
1-cyclopentyl-3-(2,4-difluorophenyl)-N-methylpropan-1-amine
CID 113390146
2-(4-fluoro-2-methylphenyl)-N-methyl-1-(4-methylcyclohexyl)ethanamine
CID 114347797
1-cycloheptyl-2-(2,5-difluorophenyl)-N-methylethanamine
CID 65399564
2-(2-bromo-4-fluorophenyl)-N-methyl-1-(4-propan-2-ylcyclohexyl)ethanamine
CID 65424573
1-cyclopentyl-3-(2,4-difluorophenyl)-N-methylpropan-2-amine
CID 64560428
N-[2-(2,4-difluorophenyl)-1-(4-methylcyclohexyl)ethyl]propan-1-amine
CID 63415659
2-(2-bromo-5-fluorophenyl)-1-cycloheptyl-N-methylethanamine
CID 65398871
[1-(7-bicyclo[4.1.0]heptanyl)-2-(2,4-difluorophenyl)ethyl]hydrazine
CID 105291870
2-(2,4-difluorophenyl)-1-(1,4-dithian-2-yl)-N-methylethanamine
CID 79966643

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine?
The IUPAC name of 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine (CID 62196245) is 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine.
What is the SMILES notation for 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine?
The canonical SMILES for 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine is CNC(Cc1ccc(F)cc1F)C1CC1.
What is the InChIKey of 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine?
The InChIKey is GFRQXACGNUJSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15F2N/c1-15-12(8-2-3-8)6-9-4-5-10(13)7-11(9)14/h4-5,7-8,12,15H,2-3,6H2,1H3.
What are the key properties of 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine?
1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine has a molecular weight of 211.25 g/mol, XLogP of 2.51, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-2-(2,4-difluorophenyl)-N-methylethanamine is sourced from PubChem (CID 62196245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).