6-(difluoromethoxy)-N-methylpyridin-3-amine

C7H8F2N2O — CID 122647422

IUPAC6-(difluoromethoxy)-N-methylpyridin-3-amine
SMILESCNc1ccc(OC(F)F)nc1
InChIInChI=1S/C7H8F2N2O/c1-10-5-2-3-6(11-4-5)12-7(8)9/h2-4,7,10H,1H3
InChIKeySIRXEVAIEYFQDK-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.72
Rot. Bonds3

About 6-(difluoromethoxy)-N-methylpyridin-3-amine

6-(difluoromethoxy)-N-methylpyridin-3-amine (PubChem CID 122647422) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is 6-(difluoromethoxy)-N-methylpyridin-3-amine.

Molecular Properties

Compound Name6-(difluoromethoxy)-N-methylpyridin-3-amine
PubChem CID122647422
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name6-(difluoromethoxy)-N-methylpyridin-3-amine
SMILESCNc1ccc(OC(F)F)nc1
InChIInChI=1S/C7H8F2N2O/c1-10-5-2-3-6(11-4-5)12-7(8)9/h2-4,7,10H,1H3
InChIKeySIRXEVAIEYFQDK-UHFFFAOYSA-N
XLogP1.72
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethoxy)-N-methylpyridin-3-amine?
The IUPAC name of 6-(difluoromethoxy)-N-methylpyridin-3-amine (CID 122647422) is 6-(difluoromethoxy)-N-methylpyridin-3-amine.
What is the SMILES notation for 6-(difluoromethoxy)-N-methylpyridin-3-amine?
The canonical SMILES for 6-(difluoromethoxy)-N-methylpyridin-3-amine is CNc1ccc(OC(F)F)nc1.
What is the InChIKey of 6-(difluoromethoxy)-N-methylpyridin-3-amine?
The InChIKey is SIRXEVAIEYFQDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c1-10-5-2-3-6(11-4-5)12-7(8)9/h2-4,7,10H,1H3.
What are the key properties of 6-(difluoromethoxy)-N-methylpyridin-3-amine?
6-(difluoromethoxy)-N-methylpyridin-3-amine has a molecular weight of 174.15 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethoxy)-N-methylpyridin-3-amine is sourced from PubChem (CID 122647422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).