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

C4H10FNO — CID 55286423

IUPAC1-fluoro-3-(methylamino)propan-2-ol
SMILESCNCC(O)CF
InChIInChI=1S/C4H10FNO/c1-6-3-4(7)2-5/h4,6-7H,2-3H2,1H3
InChIKeyDAJBQHSZEOFNOD-UHFFFAOYSA-N
MW107.13 g/mol
LogP-0.46
Rot. Bonds3

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

1-fluoro-3-(methylamino)propan-2-ol (PubChem CID 55286423) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is 1-fluoro-3-(methylamino)propan-2-ol.

Molecular Properties

Compound Name1-fluoro-3-(methylamino)propan-2-ol
PubChem CID55286423
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC Name1-fluoro-3-(methylamino)propan-2-ol
SMILESCNCC(O)CF
InChIInChI=1S/C4H10FNO/c1-6-3-4(7)2-5/h4,6-7H,2-3H2,1H3
InChIKeyDAJBQHSZEOFNOD-UHFFFAOYSA-N
XLogP-0.46
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.13
LogP ≤ 5-0.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(methylamino)propan-2-ol?
The IUPAC name of 1-fluoro-3-(methylamino)propan-2-ol (CID 55286423) is 1-fluoro-3-(methylamino)propan-2-ol.
What is the SMILES notation for 1-fluoro-3-(methylamino)propan-2-ol?
The canonical SMILES for 1-fluoro-3-(methylamino)propan-2-ol is CNCC(O)CF.
What is the InChIKey of 1-fluoro-3-(methylamino)propan-2-ol?
The InChIKey is DAJBQHSZEOFNOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c1-6-3-4(7)2-5/h4,6-7H,2-3H2,1H3.
What are the key properties of 1-fluoro-3-(methylamino)propan-2-ol?
1-fluoro-3-(methylamino)propan-2-ol has a molecular weight of 107.13 g/mol, XLogP of -0.46, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(methylamino)propan-2-ol is sourced from PubChem (CID 55286423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).