1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine

C13H19FN2 — CID 143816752

IUPAC1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine
SMILESCNCN1CCC(c2ccccc2F)CC1
InChIInChI=1S/C13H19FN2/c1-15-10-16-8-6-11(7-9-16)12-4-2-3-5-13(12)14/h2-5,11,15H,6-10H2,1H3
InChIKeyMTHODKCWFMREIS-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.18
Rot. Bonds3

About 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine

1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine (PubChem CID 143816752) has the molecular formula C13H19FN2 and a molecular weight of 222.31 g/mol. Its IUPAC name is 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine
PubChem CID143816752
Molecular FormulaC13H19FN2
Molecular Weight222.31 g/mol
Exact Mass222.15
IUPAC Name1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine
SMILESCNCN1CCC(c2ccccc2F)CC1
InChIInChI=1S/C13H19FN2/c1-15-10-16-8-6-11(7-9-16)12-4-2-3-5-13(12)14/h2-5,11,15H,6-10H2,1H3
InChIKeyMTHODKCWFMREIS-UHFFFAOYSA-N
XLogP2.18
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine?
The IUPAC name of 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine (CID 143816752) is 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine?
The canonical SMILES for 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine is CNCN1CCC(c2ccccc2F)CC1.
What is the InChIKey of 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine?
The InChIKey is MTHODKCWFMREIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2/c1-15-10-16-8-6-11(7-9-16)12-4-2-3-5-13(12)14/h2-5,11,15H,6-10H2,1H3.
What are the key properties of 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine?
1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine has a molecular weight of 222.31 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(2-fluorophenyl)piperidin-1-yl]-N-methylmethanamine is sourced from PubChem (CID 143816752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).