1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine

C10H15FN2O — CID 104738162

IUPAC1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine
SMILESCNC(CCOC)c1ccncc1F
InChIInChI=1S/C10H15FN2O/c1-12-10(4-6-14-2)8-3-5-13-7-9(8)11/h3,5,7,10,12H,4,6H2,1-2H3
InChIKeyWFKUONIOMCNZBR-UHFFFAOYSA-N
MW198.24 g/mol
LogP1.52
Rot. Bonds5

About 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine

1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine (PubChem CID 104738162) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine.

Molecular Properties

Compound Name1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine
PubChem CID104738162
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine
SMILESCNC(CCOC)c1ccncc1F
InChIInChI=1S/C10H15FN2O/c1-12-10(4-6-14-2)8-3-5-13-7-9(8)11/h3,5,7,10,12H,4,6H2,1-2H3
InChIKeyWFKUONIOMCNZBR-UHFFFAOYSA-N
XLogP1.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.24
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-fluoro-4-pyridinyl)-N-methyl-3-propoxypropan-1-amine
CID 105181877
[1-(3-fluoro-4-pyridinyl)-3-(2-methoxyethoxy)propyl]hydrazine
CID 102930056
1-(3-fluoro-4-pyridinyl)-3-methoxypropan-1-ol
CID 104737985
1-(3-fluoro-4-pyridinyl)-4-methoxy-N-propylbutan-1-amine
CID 113447246
1-(3-fluoro-4-pyridinyl)-N-methyl-2-propylsulfanylethanamine
CID 104738272
1-(3-fluoro-4-pyridinyl)-2-(2-methoxyethylamino)ethanol
CID 104739344
[3-methoxy-1-(4-methyl-3-pyridinyl)propyl]hydrazine
CID 105206412
[4-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
CID 105335371
1-(3-fluoro-4-pyridinyl)-N-methyl-2-(2-methyltetrazol-5-yl)ethanamine
CID 107050582
[1-(3-fluoro-4-pyridinyl)-3-(4-methoxyphenyl)propyl]hydrazine
CID 105258537
1-(3-fluoro-4-pyridinyl)-3-methoxy-N-propylbutan-1-amine
CID 113447304
1-(3-fluoro-4-pyridinyl)-1-(4-methoxy-1-propan-2-ylpyrazol-5-yl)-N-methylmethanamine
CID 114659373

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine?
The IUPAC name of 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine (CID 104738162) is 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine.
What is the SMILES notation for 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine?
The canonical SMILES for 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine is CNC(CCOC)c1ccncc1F.
What is the InChIKey of 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine?
The InChIKey is WFKUONIOMCNZBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c1-12-10(4-6-14-2)8-3-5-13-7-9(8)11/h3,5,7,10,12H,4,6H2,1-2H3.
What are the key properties of 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine?
1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine has a molecular weight of 198.24 g/mol, XLogP of 1.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-pyridinyl)-3-methoxy-N-methylpropan-1-amine is sourced from PubChem (CID 104738162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).