1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine

C14H15FN2O — CID 105065221

IUPAC1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
SMILESCNC(c1cccc(F)c1)c1ccncc1OC
InChIInChI=1S/C14H15FN2O/c1-16-14(10-4-3-5-11(15)8-10)12-6-7-17-9-13(12)18-2/h3-9,14,16H,1-2H3
InChIKeyOXUDSDFVEDPTNG-UHFFFAOYSA-N
MW246.28 g/mol
LogP2.54
Rot. Bonds4

About 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine

1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine (PubChem CID 105065221) has the molecular formula C14H15FN2O and a molecular weight of 246.28 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
PubChem CID105065221
Molecular FormulaC14H15FN2O
Molecular Weight246.28 g/mol
Exact Mass246.12
IUPAC Name1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine
SMILESCNC(c1cccc(F)c1)c1ccncc1OC
InChIInChI=1S/C14H15FN2O/c1-16-14(10-4-3-5-11(15)8-10)12-6-7-17-9-13(12)18-2/h3-9,14,16H,1-2H3
InChIKeyOXUDSDFVEDPTNG-UHFFFAOYSA-N
XLogP2.54
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine (CID 105065221) is 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine is CNC(c1cccc(F)c1)c1ccncc1OC.
What is the InChIKey of 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
The InChIKey is OXUDSDFVEDPTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-16-14(10-4-3-5-11(15)8-10)12-6-7-17-9-13(12)18-2/h3-9,14,16H,1-2H3.
What are the key properties of 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine?
1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine has a molecular weight of 246.28 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-1-(3-methoxy-4-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 105065221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).