4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine

C13H17N3 — CID 129214084

IUPAC4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine
SMILESCCc1nn(-c2ccncc2)c(CC)c1C
InChIInChI=1S/C13H17N3/c1-4-12-10(3)13(5-2)16(15-12)11-6-8-14-9-7-11/h6-9H,4-5H2,1-3H3
InChIKeyITVOZPLGSMZWES-UHFFFAOYSA-N
MW215.30 g/mol
LogP2.70
Rot. Bonds3

About 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine

4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine (PubChem CID 129214084) has the molecular formula C13H17N3 and a molecular weight of 215.30 g/mol. Its IUPAC name is 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine.

Molecular Properties

Compound Name4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine
PubChem CID129214084
Molecular FormulaC13H17N3
Molecular Weight215.30 g/mol
Exact Mass215.14
IUPAC Name4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine
SMILESCCc1nn(-c2ccncc2)c(CC)c1C
InChIInChI=1S/C13H17N3/c1-4-12-10(3)13(5-2)16(15-12)11-6-8-14-9-7-11/h6-9H,4-5H2,1-3H3
InChIKeyITVOZPLGSMZWES-UHFFFAOYSA-N
XLogP2.70
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine?
The IUPAC name of 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine (CID 129214084) is 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine.
What is the SMILES notation for 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine?
The canonical SMILES for 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine is CCc1nn(-c2ccncc2)c(CC)c1C.
What is the InChIKey of 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine?
The InChIKey is ITVOZPLGSMZWES-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3/c1-4-12-10(3)13(5-2)16(15-12)11-6-8-14-9-7-11/h6-9H,4-5H2,1-3H3.
What are the key properties of 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine?
4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine has a molecular weight of 215.30 g/mol, XLogP of 2.70, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-diethyl-4-methylpyrazol-1-yl)pyridine is sourced from PubChem (CID 129214084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).