1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine

C13H12F2N2 — CID 54967877

IUPAC1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cncc(F)c1
InChIInChI=1S/C13H12F2N2/c1-16-13(9-2-4-11(14)5-3-9)10-6-12(15)8-17-7-10/h2-8,13,16H,1H3
InChIKeyUYFSODSIWSIGHZ-UHFFFAOYSA-N
MW234.25 g/mol
LogP2.67
Rot. Bonds3

About 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine

1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine (PubChem CID 54967877) has the molecular formula C13H12F2N2 and a molecular weight of 234.25 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
PubChem CID54967877
Molecular FormulaC13H12F2N2
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC Name1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
SMILESCNC(c1ccc(F)cc1)c1cncc(F)c1
InChIInChI=1S/C13H12F2N2/c1-16-13(9-2-4-11(14)5-3-9)10-6-12(15)8-17-7-10/h2-8,13,16H,1H3
InChIKeyUYFSODSIWSIGHZ-UHFFFAOYSA-N
XLogP2.67
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 54967967
1-(3,4-dichlorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 81492170
1-(4-tert-butylphenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 115805098
1-(5-fluoro-2-pyridinyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 79712254
1,1-bis(4-fluorophenyl)-N-methylmethanamine
CID 22660961
1-(5-fluoro-3-pyridinyl)-1-(5-methoxy-3-pyridinyl)-N-methylmethanamine
CID 105175369
1-(5-fluoro-3-pyridinyl)-1-(3-methoxy-4-methylphenyl)-N-methylmethanamine
CID 115804713
(1R)-1-(4-fluorophenyl)-N-methyl-1-pyridin-3-ylmethanamine
CID 51693922
1-(5-fluoro-3-pyridinyl)-N-methyl-1-quinolin-3-ylmethanamine
CID 105097865
1-(5-bromofuran-2-yl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 115804627
1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 105143391
1-(2-chloro-4-methylphenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine
CID 106857038

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine?
The IUPAC name of 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine (CID 54967877) is 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine.
What is the SMILES notation for 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine?
The canonical SMILES for 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine is CNC(c1ccc(F)cc1)c1cncc(F)c1.
What is the InChIKey of 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine?
The InChIKey is UYFSODSIWSIGHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12F2N2/c1-16-13(9-2-4-11(14)5-3-9)10-6-12(15)8-17-7-10/h2-8,13,16H,1H3.
What are the key properties of 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine?
1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine has a molecular weight of 234.25 g/mol, XLogP of 2.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-1-(5-fluoro-3-pyridinyl)-N-methylmethanamine is sourced from PubChem (CID 54967877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).