2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine

C10H13F2NO — CID 69346788

IUPAC2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine
SMILESCOc1ccc(C(C)(F)CN)c(F)c1
InChIInChI=1S/C10H13F2NO/c1-10(12,6-13)8-4-3-7(14-2)5-9(8)11/h3-5H,6,13H2,1-2H3
InChIKeyFPOXXXJNDULACL-UHFFFAOYSA-N
MW201.22 g/mol
LogP1.98
Rot. Bonds3

About 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine

2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine (PubChem CID 69346788) has the molecular formula C10H13F2NO and a molecular weight of 201.22 g/mol. Its IUPAC name is 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine.

Molecular Properties

Compound Name2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine
PubChem CID69346788
Molecular FormulaC10H13F2NO
Molecular Weight201.22 g/mol
Exact Mass201.10
IUPAC Name2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine
SMILESCOc1ccc(C(C)(F)CN)c(F)c1
InChIInChI=1S/C10H13F2NO/c1-10(12,6-13)8-4-3-7(14-2)5-9(8)11/h3-5H,6,13H2,1-2H3
InChIKeyFPOXXXJNDULACL-UHFFFAOYSA-N
XLogP1.98
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.22
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-4-methoxy-1-(2-methylbutan-2-yl)benzene
CID 134360467
1-(3,4-dimethylphenyl)-1-(2-fluoro-4-methoxyphenyl)ethanamine
CID 103395200
1-[dichloro-(4-fluorophenyl)methyl]-2-fluoro-4-methoxybenzene
CID 69055296
4-(1-amino-2-fluoropropan-2-yl)-3-methoxyphenol
CID 105426160
2-[4-methoxy-2-(trifluoromethyl)phenyl]propan-2-amine
CID 117337731
(2R)-2-(2,4-dichlorophenyl)-2-fluoropropan-1-amine
CID 124567259
2-amino-2-(2-fluoro-5-methoxyphenyl)propan-1-ol
CID 55271150
2-fluoro-4-methoxyaniline
CID 3756383
1-(2-fluoro-4-methoxyphenyl)-1-(5-fluoro-2-pyridinyl)ethanamine
CID 103395231
1-(2-fluoro-4-methoxyphenyl)-1-phenylpropan-1-ol
CID 103394960
3-(1-amino-2-fluoropropan-2-yl)-4-methoxyphenol
CID 105425939
propan-2-yl 2-amino-2-(2-fluoro-4-methoxyphenyl)-4,4-dimethylpentanoate;hydrochloride
CID 175021538

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine?
The IUPAC name of 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine (CID 69346788) is 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine.
What is the SMILES notation for 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine?
The canonical SMILES for 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine is COc1ccc(C(C)(F)CN)c(F)c1.
What is the InChIKey of 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine?
The InChIKey is FPOXXXJNDULACL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2NO/c1-10(12,6-13)8-4-3-7(14-2)5-9(8)11/h3-5H,6,13H2,1-2H3.
What are the key properties of 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine?
2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine has a molecular weight of 201.22 g/mol, XLogP of 1.98, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(2-fluoro-4-methoxyphenyl)propan-1-amine is sourced from PubChem (CID 69346788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).