1-fluoro-3-(2-methoxyethylamino)propan-2-ol

C6H14FNO2 — CID 131182194

IUPAC1-fluoro-3-(2-methoxyethylamino)propan-2-ol
SMILESCOCCNCC(O)CF
InChIInChI=1S/C6H14FNO2/c1-10-3-2-8-5-6(9)4-7/h6,8-9H,2-5H2,1H3
InChIKeyISUJBABTKRATLX-UHFFFAOYSA-N
MW151.18 g/mol
LogP-0.45
Rot. Bonds6

About 1-fluoro-3-(2-methoxyethylamino)propan-2-ol

1-fluoro-3-(2-methoxyethylamino)propan-2-ol (PubChem CID 131182194) has the molecular formula C6H14FNO2 and a molecular weight of 151.18 g/mol. Its IUPAC name is 1-fluoro-3-(2-methoxyethylamino)propan-2-ol.

Molecular Properties

Compound Name1-fluoro-3-(2-methoxyethylamino)propan-2-ol
PubChem CID131182194
Molecular FormulaC6H14FNO2
Molecular Weight151.18 g/mol
Exact Mass151.10
IUPAC Name1-fluoro-3-(2-methoxyethylamino)propan-2-ol
SMILESCOCCNCC(O)CF
InChIInChI=1S/C6H14FNO2/c1-10-3-2-8-5-6(9)4-7/h6,8-9H,2-5H2,1H3
InChIKeyISUJBABTKRATLX-UHFFFAOYSA-N
XLogP-0.45
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.18
LogP ≤ 5-0.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxyethylamino)butan-2-ol
CID 60885611
1-(2-methoxyethylamino)-3-[methyl(propyl)amino]propan-2-ol
CID 115474889
1-(2-methoxyethylamino)hept-5-yn-2-ol
CID 104813071
1-(3,5-difluorophenoxy)-3-(2-methoxyethylamino)propan-2-ol
CID 113317787
1-(2-methoxyethylamino)-3-[2-methoxyethyl(1-methoxypropan-2-yl)amino]propan-2-ol
CID 115475131
1-(3,4-dimethylpyrrolidin-1-yl)-3-(2-methoxyethylamino)propan-2-ol
CID 115475430
1-(cyclopropylmethoxy)-3-(2-methoxyethylamino)propan-2-ol
CID 60633025
2-hydroxy-3-(2-methoxyethylamino)propanamide
CID 106174482
1-(ethylamino)-3-fluoropropan-2-ol
CID 59154890
1-(2-methoxyethylamino)-3-(4-propylpiperazin-1-yl)propan-2-ol
CID 113317417
1-(2-methoxyethylamino)-3-(4-methylcyclohexyl)oxypropan-2-ol
CID 60632831
1-(3,5-dimethylphenoxy)-3-(2-methoxyethylamino)propan-2-ol
CID 60633357

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(2-methoxyethylamino)propan-2-ol?
The IUPAC name of 1-fluoro-3-(2-methoxyethylamino)propan-2-ol (CID 131182194) is 1-fluoro-3-(2-methoxyethylamino)propan-2-ol.
What is the SMILES notation for 1-fluoro-3-(2-methoxyethylamino)propan-2-ol?
The canonical SMILES for 1-fluoro-3-(2-methoxyethylamino)propan-2-ol is COCCNCC(O)CF.
What is the InChIKey of 1-fluoro-3-(2-methoxyethylamino)propan-2-ol?
The InChIKey is ISUJBABTKRATLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14FNO2/c1-10-3-2-8-5-6(9)4-7/h6,8-9H,2-5H2,1H3.
What are the key properties of 1-fluoro-3-(2-methoxyethylamino)propan-2-ol?
1-fluoro-3-(2-methoxyethylamino)propan-2-ol has a molecular weight of 151.18 g/mol, XLogP of -0.45, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(2-methoxyethylamino)propan-2-ol is sourced from PubChem (CID 131182194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).