3-(ethylamino)-2-fluoropropan-1-ol

C5H12FNO — CID 142802117

IUPAC3-(ethylamino)-2-fluoropropan-1-ol
SMILESCCNCC(F)CO
InChIInChI=1S/C5H12FNO/c1-2-7-3-5(6)4-8/h5,7-8H,2-4H2,1H3
InChIKeyJPZKJXHDXZECLZ-UHFFFAOYSA-N
MW121.16 g/mol
LogP-0.07
Rot. Bonds4

About 3-(ethylamino)-2-fluoropropan-1-ol

3-(ethylamino)-2-fluoropropan-1-ol (PubChem CID 142802117) has the molecular formula C5H12FNO and a molecular weight of 121.16 g/mol. Its IUPAC name is 3-(ethylamino)-2-fluoropropan-1-ol.

Molecular Properties

Compound Name3-(ethylamino)-2-fluoropropan-1-ol
PubChem CID142802117
Molecular FormulaC5H12FNO
Molecular Weight121.16 g/mol
Exact Mass121.09
IUPAC Name3-(ethylamino)-2-fluoropropan-1-ol
SMILESCCNCC(F)CO
InChIInChI=1S/C5H12FNO/c1-2-7-3-5(6)4-8/h5,7-8H,2-4H2,1H3
InChIKeyJPZKJXHDXZECLZ-UHFFFAOYSA-N
XLogP-0.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.16
LogP ≤ 5-0.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(ethylamino)-2-fluoropropan-1-ol?
The IUPAC name of 3-(ethylamino)-2-fluoropropan-1-ol (CID 142802117) is 3-(ethylamino)-2-fluoropropan-1-ol.
What is the SMILES notation for 3-(ethylamino)-2-fluoropropan-1-ol?
The canonical SMILES for 3-(ethylamino)-2-fluoropropan-1-ol is CCNCC(F)CO.
What is the InChIKey of 3-(ethylamino)-2-fluoropropan-1-ol?
The InChIKey is JPZKJXHDXZECLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12FNO/c1-2-7-3-5(6)4-8/h5,7-8H,2-4H2,1H3.
What are the key properties of 3-(ethylamino)-2-fluoropropan-1-ol?
3-(ethylamino)-2-fluoropropan-1-ol has a molecular weight of 121.16 g/mol, XLogP of -0.07, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylamino)-2-fluoropropan-1-ol is sourced from PubChem (CID 142802117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).