4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine

C12H15N3 — CID 121279540

IUPAC4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine
SMILESCCn1cc(-c2cc(C)nc(C)c2)cn1
InChIInChI=1S/C12H15N3/c1-4-15-8-12(7-13-15)11-5-9(2)14-10(3)6-11/h5-8H,4H2,1-3H3
InChIKeyPIDUWIJSBDLNMP-UHFFFAOYSA-N
MW201.27 g/mol
LogP2.58
Rot. Bonds2

About 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine

4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine (PubChem CID 121279540) has the molecular formula C12H15N3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine.

Molecular Properties

Compound Name4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine
PubChem CID121279540
Molecular FormulaC12H15N3
Molecular Weight201.27 g/mol
Exact Mass201.13
IUPAC Name4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine
SMILESCCn1cc(-c2cc(C)nc(C)c2)cn1
InChIInChI=1S/C12H15N3/c1-4-15-8-12(7-13-15)11-5-9(2)14-10(3)6-11/h5-8H,4H2,1-3H3
InChIKeyPIDUWIJSBDLNMP-UHFFFAOYSA-N
XLogP2.58
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-4-(1-propylpyrazol-4-yl)pyridine;ethane
CID 145062525
5-(1-ethylpyrazol-4-yl)-2-methylpyridine
CID 58399288
4-(1-ethylpyrazol-4-yl)-2,6-dimethylbenzoic acid
CID 172876924
2-(2,2-dimethylpropyl)-5-(1-ethylpyrazol-4-yl)-3-methylpyridine
CID 141130510
6-(1-ethylpyrazol-4-yl)pyrimidine-2,4-diamine
CID 106878454
[3-(1-ethylpyrazol-4-yl)phenyl]boronic acid
CID 130141673
4-(4-tert-butylphenyl)-1-ethylpyrazole
CID 126653145
1-(2,6-dimethyl-4-pyridinyl)-2-(1-ethylpyrazol-4-yl)ethanamine
CID 107503308
4-chloro-6-(chloromethyl)-2-(1-ethylpyrazol-4-yl)pyrimidine
CID 95732740
6-(1-ethylpyrazol-4-yl)-1-methylindole-4-carboxylic acid
CID 171369425
2-[3-(1-ethylpyrazol-4-yl)phenyl]ethanol
CID 166638798
5-bromo-4-chloro-2-(1-ethylpyrazol-4-yl)-6-methylpyrimidine
CID 103570148

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine?
The IUPAC name of 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine (CID 121279540) is 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine.
What is the SMILES notation for 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine?
The canonical SMILES for 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine is CCn1cc(-c2cc(C)nc(C)c2)cn1.
What is the InChIKey of 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine?
The InChIKey is PIDUWIJSBDLNMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3/c1-4-15-8-12(7-13-15)11-5-9(2)14-10(3)6-11/h5-8H,4H2,1-3H3.
What are the key properties of 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine?
4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine has a molecular weight of 201.27 g/mol, XLogP of 2.58, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine is sourced from PubChem (CID 121279540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).