[5-(difluoromethoxy)-2-pyridinyl]methanamine

C7H8F2N2O — CID 75356577

IUPAC[5-(difluoromethoxy)-2-pyridinyl]methanamine
SMILESNCc1ccc(OC(F)F)cn1
InChIInChI=1S/C7H8F2N2O/c8-7(9)12-6-2-1-5(3-10)11-4-6/h1-2,4,7H,3,10H2
InChIKeyWZAVUAHOHZANGQ-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.14
Rot. Bonds3

About [5-(difluoromethoxy)-2-pyridinyl]methanamine

[5-(difluoromethoxy)-2-pyridinyl]methanamine (PubChem CID 75356577) has the molecular formula C7H8F2N2O and a molecular weight of 174.15 g/mol. Its IUPAC name is [5-(difluoromethoxy)-2-pyridinyl]methanamine.

Molecular Properties

Compound Name[5-(difluoromethoxy)-2-pyridinyl]methanamine
PubChem CID75356577
Molecular FormulaC7H8F2N2O
Molecular Weight174.15 g/mol
Exact Mass174.06
IUPAC Name[5-(difluoromethoxy)-2-pyridinyl]methanamine
SMILESNCc1ccc(OC(F)F)cn1
InChIInChI=1S/C7H8F2N2O/c8-7(9)12-6-2-1-5(3-10)11-4-6/h1-2,4,7H,3,10H2
InChIKeyWZAVUAHOHZANGQ-UHFFFAOYSA-N
XLogP1.14
TPSA48.14 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 ≤ 51.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [5-(difluoromethoxy)-2-pyridinyl]methanamine?
The IUPAC name of [5-(difluoromethoxy)-2-pyridinyl]methanamine (CID 75356577) is [5-(difluoromethoxy)-2-pyridinyl]methanamine.
What is the SMILES notation for [5-(difluoromethoxy)-2-pyridinyl]methanamine?
The canonical SMILES for [5-(difluoromethoxy)-2-pyridinyl]methanamine is NCc1ccc(OC(F)F)cn1.
What is the InChIKey of [5-(difluoromethoxy)-2-pyridinyl]methanamine?
The InChIKey is WZAVUAHOHZANGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O/c8-7(9)12-6-2-1-5(3-10)11-4-6/h1-2,4,7H,3,10H2.
What are the key properties of [5-(difluoromethoxy)-2-pyridinyl]methanamine?
[5-(difluoromethoxy)-2-pyridinyl]methanamine has a molecular weight of 174.15 g/mol, XLogP of 1.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(difluoromethoxy)-2-pyridinyl]methanamine is sourced from PubChem (CID 75356577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).