2-(2,4-difluorophenyl)-2-methoxyethanamine

C9H11F2NO — CID 53276228

IUPAC2-(2,4-difluorophenyl)-2-methoxyethanamine
SMILESCOC(CN)c1ccc(F)cc1F
InChIInChI=1S/C9H11F2NO/c1-13-9(5-12)7-3-2-6(10)4-8(7)11/h2-4,9H,5,12H2,1H3
InChIKeyPEVOPAZHWALTCA-UHFFFAOYSA-N
MW187.19 g/mol
LogP1.61
Rot. Bonds3

About 2-(2,4-difluorophenyl)-2-methoxyethanamine

2-(2,4-difluorophenyl)-2-methoxyethanamine (PubChem CID 53276228) has the molecular formula C9H11F2NO and a molecular weight of 187.19 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-2-methoxyethanamine.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-2-methoxyethanamine
PubChem CID53276228
Molecular FormulaC9H11F2NO
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name2-(2,4-difluorophenyl)-2-methoxyethanamine
SMILESCOC(CN)c1ccc(F)cc1F
InChIInChI=1S/C9H11F2NO/c1-13-9(5-12)7-3-2-6(10)4-8(7)11/h2-4,9H,5,12H2,1H3
InChIKeyPEVOPAZHWALTCA-UHFFFAOYSA-N
XLogP1.61
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,4-difluorophenyl)-2-methoxy-N-methylethanamine
CID 53276205
1-(2,4-difluorophenyl)-2,2-dimethoxyethanamine
CID 79492526
1-(2,4-difluorophenyl)-2-methoxybutan-1-amine
CID 116715202
1-(2,4-difluorophenyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 62539902
2-[(2,4-difluorophenyl)-fluoromethyl]-3-methylbutan-1-amine
CID 107443637
2-(2,4-difluorophenyl)-2-(3,4-dimethoxypyrrolidin-1-yl)ethanamine
CID 103531886
(1R)-1-(2,4-difluorophenyl)-3-fluoropropan-1-amine;hydrochloride
CID 171199037
1-(2,4-difluorophenyl)-N-methyl-N-propylethane-1,2-diamine
CID 43271035
(2,4-difluorophenyl)-(2-fluoro-4,5-dimethoxyphenyl)methanamine
CID 62867795
4-(5-fluoro-2-methoxyphenyl)-4-methoxybutan-1-amine
CID 112509941
1-(2,4-difluorophenyl)-N-(3-methyl-2-propan-2-ylbutyl)ethane-1,2-diamine
CID 102912601
2-methoxy-2-(3,4,5-trifluorophenyl)ethanamine
CID 66073215

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-2-methoxyethanamine?
The IUPAC name of 2-(2,4-difluorophenyl)-2-methoxyethanamine (CID 53276228) is 2-(2,4-difluorophenyl)-2-methoxyethanamine.
What is the SMILES notation for 2-(2,4-difluorophenyl)-2-methoxyethanamine?
The canonical SMILES for 2-(2,4-difluorophenyl)-2-methoxyethanamine is COC(CN)c1ccc(F)cc1F.
What is the InChIKey of 2-(2,4-difluorophenyl)-2-methoxyethanamine?
The InChIKey is PEVOPAZHWALTCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO/c1-13-9(5-12)7-3-2-6(10)4-8(7)11/h2-4,9H,5,12H2,1H3.
What are the key properties of 2-(2,4-difluorophenyl)-2-methoxyethanamine?
2-(2,4-difluorophenyl)-2-methoxyethanamine has a molecular weight of 187.19 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-2-methoxyethanamine is sourced from PubChem (CID 53276228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).