3-fluoro-N-methoxypropan-1-amine

C4H10FNO — CID 81106951

IUPAC3-fluoro-N-methoxypropan-1-amine
SMILESCONCCCF
InChIInChI=1S/C4H10FNO/c1-7-6-4-2-3-5/h6H,2-4H2,1H3
InChIKeyUEESCOSNJMBITL-UHFFFAOYSA-N
MW107.13 g/mol
LogP0.50
Rot. Bonds4

About 3-fluoro-N-methoxypropan-1-amine

3-fluoro-N-methoxypropan-1-amine (PubChem CID 81106951) has the molecular formula C4H10FNO and a molecular weight of 107.13 g/mol. Its IUPAC name is 3-fluoro-N-methoxypropan-1-amine.

Molecular Properties

Compound Name3-fluoro-N-methoxypropan-1-amine
PubChem CID81106951
Molecular FormulaC4H10FNO
Molecular Weight107.13 g/mol
Exact Mass107.07
IUPAC Name3-fluoro-N-methoxypropan-1-amine
SMILESCONCCCF
InChIInChI=1S/C4H10FNO/c1-7-6-4-2-3-5/h6H,2-4H2,1H3
InChIKeyUEESCOSNJMBITL-UHFFFAOYSA-N
XLogP0.50
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500107.13
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Methoxy(propan-2-YL)amine
CID 12651820
1-Propanamine, N-methoxy-
CID 11815284
Butyl(methoxy)amine
CID 12651819
N-methoxy-2-methylpropan-1-amine
CID 17885866
N-ethoxypropan-1-amine
CID 18936580
(3-Aminopropyl)(methoxy)amine
CID 19100836
2-(3-(Aminopropyl)amino)methanol
CID 20349732
N-propoxypropan-1-amine
CID 20470531
N-propoxyethanamine
CID 53968086
3-(Ethylaminooxy)-2-fluoropropan-1-amine
CID 21652978
3,3,3-trifluoro-N-methoxypropan-1-amine
CID 64973781
N-(2,2,2-trifluoroethoxy)propan-1-amine
CID 82710871

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methoxypropan-1-amine?
The IUPAC name of 3-fluoro-N-methoxypropan-1-amine (CID 81106951) is 3-fluoro-N-methoxypropan-1-amine.
What is the SMILES notation for 3-fluoro-N-methoxypropan-1-amine?
The canonical SMILES for 3-fluoro-N-methoxypropan-1-amine is CONCCCF.
What is the InChIKey of 3-fluoro-N-methoxypropan-1-amine?
The InChIKey is UEESCOSNJMBITL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10FNO/c1-7-6-4-2-3-5/h6H,2-4H2,1H3.
What are the key properties of 3-fluoro-N-methoxypropan-1-amine?
3-fluoro-N-methoxypropan-1-amine has a molecular weight of 107.13 g/mol, XLogP of 0.50, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methoxypropan-1-amine is sourced from PubChem (CID 81106951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).