N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine

C14H15FN2O — CID 63378666

IUPACN-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine
SMILESCOc1cccc(CNCc2ccccc2F)n1
InChIInChI=1S/C14H15FN2O/c1-18-14-8-4-6-12(17-14)10-16-9-11-5-2-3-7-13(11)15/h2-8,16H,9-10H2,1H3
InChIKeyMNTQNZICXYSJEG-UHFFFAOYSA-N
MW246.29 g/mol
LogP2.52
Rot. Bonds5

About N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine

N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine (PubChem CID 63378666) has the molecular formula C14H15FN2O and a molecular weight of 246.29 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine
PubChem CID63378666
Molecular FormulaC14H15FN2O
Molecular Weight246.29 g/mol
Exact Mass246.12
IUPAC NameN-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine
SMILESCOc1cccc(CNCc2ccccc2F)n1
InChIInChI=1S/C14H15FN2O/c1-18-14-8-4-6-12(17-14)10-16-9-11-5-2-3-7-13(11)15/h2-8,16H,9-10H2,1H3
InChIKeyMNTQNZICXYSJEG-UHFFFAOYSA-N
XLogP2.52
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine?
The IUPAC name of N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine (CID 63378666) is N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine is COc1cccc(CNCc2ccccc2F)n1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine?
The InChIKey is MNTQNZICXYSJEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15FN2O/c1-18-14-8-4-6-12(17-14)10-16-9-11-5-2-3-7-13(11)15/h2-8,16H,9-10H2,1H3.
What are the key properties of N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine?
N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine has a molecular weight of 246.29 g/mol, XLogP of 2.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-1-(6-methoxy-2-pyridinyl)methanamine is sourced from PubChem (CID 63378666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).