[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine

C14H14F2N2O — CID 161169292

IUPAC[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(Oc2cccc(F)c2F)nc(C)c1CN
InChIInChI=1S/C14H14F2N2O/c1-8-6-13(18-9(2)10(8)7-17)19-12-5-3-4-11(15)14(12)16/h3-6H,7,17H2,1-2H3
InChIKeyUQYRVQKRPGBYAG-UHFFFAOYSA-N
MW264.27 g/mol
LogP3.23
Rot. Bonds3

About [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine

[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine (PubChem CID 161169292) has the molecular formula C14H14F2N2O and a molecular weight of 264.27 g/mol. Its IUPAC name is [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine.

Molecular Properties

Compound Name[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine
PubChem CID161169292
Molecular FormulaC14H14F2N2O
Molecular Weight264.27 g/mol
Exact Mass264.11
IUPAC Name[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine
SMILESCc1cc(Oc2cccc(F)c2F)nc(C)c1CN
InChIInChI=1S/C14H14F2N2O/c1-8-6-13(18-9(2)10(8)7-17)19-12-5-3-4-11(15)14(12)16/h3-6H,7,17H2,1-2H3
InChIKeyUQYRVQKRPGBYAG-UHFFFAOYSA-N
XLogP3.23
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.27
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine?
The IUPAC name of [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine (CID 161169292) is [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine.
What is the SMILES notation for [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine?
The canonical SMILES for [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine is Cc1cc(Oc2cccc(F)c2F)nc(C)c1CN.
What is the InChIKey of [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine?
The InChIKey is UQYRVQKRPGBYAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14F2N2O/c1-8-6-13(18-9(2)10(8)7-17)19-12-5-3-4-11(15)14(12)16/h3-6H,7,17H2,1-2H3.
What are the key properties of [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine?
[6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine has a molecular weight of 264.27 g/mol, XLogP of 3.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2,3-difluorophenoxy)-2,4-dimethyl-3-pyridinyl]methanamine is sourced from PubChem (CID 161169292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).