2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine

C11H15F2NO — CID 123148400

IUPAC2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine
SMILESCNC(C)(COC)c1ccc(F)cc1F
InChIInChI=1S/C11H15F2NO/c1-11(14-2,7-15-3)9-5-4-8(12)6-10(9)13/h4-6,14H,7H2,1-3H3
InChIKeyJRFDXHIFBVTWAX-UHFFFAOYSA-N
MW215.24 g/mol
LogP2.05
Rot. Bonds4

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

2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine (PubChem CID 123148400) has the molecular formula C11H15F2NO and a molecular weight of 215.24 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine
PubChem CID123148400
Molecular FormulaC11H15F2NO
Molecular Weight215.24 g/mol
Exact Mass215.11
IUPAC Name2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine
SMILESCNC(C)(COC)c1ccc(F)cc1F
InChIInChI=1S/C11H15F2NO/c1-11(14-2,7-15-3)9-5-4-8(12)6-10(9)13/h4-6,14H,7H2,1-3H3
InChIKeyJRFDXHIFBVTWAX-UHFFFAOYSA-N
XLogP2.05
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.24
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-difluorophenyl)-2-fluoro-N-methylpropan-1-amine
CID 105425208
methyl 2-(2,4-difluorophenyl)-2-(methylamino)propanoate
CID 60787394
2-(2,4-difluorophenyl)-2-(4-methoxyanilino)propan-1-ol
CID 61045474
1-(2,4-difluorophenoxy)-N,2-dimethylpropan-2-amine
CID 82126938
2-(2,4-difluorophenyl)-4-(2-methoxyethylamino)butan-2-ol
CID 66002495
1-(2,4-difluorophenyl)-1,1-difluoro-2-methylpropan-2-amine
CID 116839410
2-(cyclopentylamino)-2-(2,4-difluorophenyl)propan-1-ol
CID 61055166
methyl 4-amino-3-(2,4-difluorophenyl)-3,4-dimethylpentanoate
CID 66097553
N-[(2,5-difluorophenyl)methyl]-1-methoxy-2-methylpropan-2-amine
CID 115608052
2,4-difluoro-1-(2-methylpentan-2-yl)benzene
CID 126704363
2-(2,4-difluorophenyl)propane-1,2-diol
CID 22107607
ethyl 3-(2,4-difluorophenyl)-3-(ethylamino)butanoate
CID 65233544

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine?
The IUPAC name of 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine (CID 123148400) is 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine.
What is the SMILES notation for 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine?
The canonical SMILES for 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine is CNC(C)(COC)c1ccc(F)cc1F.
What is the InChIKey of 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine?
The InChIKey is JRFDXHIFBVTWAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F2NO/c1-11(14-2,7-15-3)9-5-4-8(12)6-10(9)13/h4-6,14H,7H2,1-3H3.
What are the key properties of 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine?
2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine has a molecular weight of 215.24 g/mol, XLogP of 2.05, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-1-methoxy-N-methylpropan-2-amine is sourced from PubChem (CID 123148400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).