4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine

C9H9FN4O — CID 67187364

IUPAC4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine
SMILESCOc1ccc(-c2[nH]nc(N)c2F)cn1
InChIInChI=1S/C9H9FN4O/c1-15-6-3-2-5(4-12-6)8-7(10)9(11)14-13-8/h2-4H,1H3,(H3,11,13,14)
InChIKeyCINDIAHFSRDPND-UHFFFAOYSA-N
MW208.20 g/mol
LogP1.20
Rot. Bonds2

About 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine

4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine (PubChem CID 67187364) has the molecular formula C9H9FN4O and a molecular weight of 208.20 g/mol. Its IUPAC name is 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine
PubChem CID67187364
Molecular FormulaC9H9FN4O
Molecular Weight208.20 g/mol
Exact Mass208.08
IUPAC Name4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine
SMILESCOc1ccc(-c2[nH]nc(N)c2F)cn1
InChIInChI=1S/C9H9FN4O/c1-15-6-3-2-5(4-12-6)8-7(10)9(11)14-13-8/h2-4H,1H3,(H3,11,13,14)
InChIKeyCINDIAHFSRDPND-UHFFFAOYSA-N
XLogP1.20
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.20
LogP ≤ 51.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine?
The IUPAC name of 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine (CID 67187364) is 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine?
The canonical SMILES for 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine is COc1ccc(-c2[nH]nc(N)c2F)cn1.
What is the InChIKey of 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine?
The InChIKey is CINDIAHFSRDPND-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN4O/c1-15-6-3-2-5(4-12-6)8-7(10)9(11)14-13-8/h2-4H,1H3,(H3,11,13,14).
What are the key properties of 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine?
4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine has a molecular weight of 208.20 g/mol, XLogP of 1.20, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-5-(6-methoxy-3-pyridinyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 67187364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).