4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine

C9H7F2N3O — CID 146279888

IUPAC4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine
SMILESFC(F)Oc1ccnc(-c2ccn[nH]2)c1
InChIInChI=1S/C9H7F2N3O/c10-9(11)15-6-1-3-12-8(5-6)7-2-4-13-14-7/h1-5,9H,(H,13,14)
InChIKeyHTSNEDJBQLRVAN-UHFFFAOYSA-N
MW211.17 g/mol
LogP2.07
Rot. Bonds3

About 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine

4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine (PubChem CID 146279888) has the molecular formula C9H7F2N3O and a molecular weight of 211.17 g/mol. Its IUPAC name is 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine.

Molecular Properties

Compound Name4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine
PubChem CID146279888
Molecular FormulaC9H7F2N3O
Molecular Weight211.17 g/mol
Exact Mass211.06
IUPAC Name4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine
SMILESFC(F)Oc1ccnc(-c2ccn[nH]2)c1
InChIInChI=1S/C9H7F2N3O/c10-9(11)15-6-1-3-12-8(5-6)7-2-4-13-14-7/h1-5,9H,(H,13,14)
InChIKeyHTSNEDJBQLRVAN-UHFFFAOYSA-N
XLogP2.07
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.17
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine?
The IUPAC name of 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine (CID 146279888) is 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine.
What is the SMILES notation for 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine?
The canonical SMILES for 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine is FC(F)Oc1ccnc(-c2ccn[nH]2)c1.
What is the InChIKey of 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine?
The InChIKey is HTSNEDJBQLRVAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F2N3O/c10-9(11)15-6-1-3-12-8(5-6)7-2-4-13-14-7/h1-5,9H,(H,13,14).
What are the key properties of 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine?
4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine has a molecular weight of 211.17 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethoxy)-2-(1H-pyrazol-5-yl)pyridine is sourced from PubChem (CID 146279888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).