4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine

C10H15N3 — CID 62800475

IUPAC4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine
SMILESCCn1cc(C2=CCNCC2)cn1
InChIInChI=1S/C10H15N3/c1-2-13-8-10(7-12-13)9-3-5-11-6-4-9/h3,7-8,11H,2,4-6H2,1H3
InChIKeyYSULVVCXOFPCAK-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.28
Rot. Bonds2

About 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine

4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine (PubChem CID 62800475) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine.

Molecular Properties

Compound Name4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine
PubChem CID62800475
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine
SMILESCCn1cc(C2=CCNCC2)cn1
InChIInChI=1S/C10H15N3/c1-2-13-8-10(7-12-13)9-3-5-11-6-4-9/h3,7-8,11H,2,4-6H2,1H3
InChIKeyYSULVVCXOFPCAK-UHFFFAOYSA-N
XLogP1.28
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[4-(1-methylpyrazol-4-yl)phenyl]-1,2,3,6-tetrahydropyridine
CID 118144094
5-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridin-3-ol
CID 165452374
4-(2-ethylpyrazol-3-yl)-1,2,3,6-tetrahydropyridine
CID 63974644
1-ethyl-4-(1H-imidazol-5-yl)pyrazole;hydrochloride
CID 67500295
4-chloro-5-(1-ethylpyrazol-4-yl)-1H-pyrazole
CID 19621326
4-(1-ethylpyrazol-4-yl)-2,6-dimethylpyridine
CID 121279540
4-[[5-(1-ethylpyrazol-4-yl)imidazol-1-yl]methyl]piperidine
CID 103571159
4-[4-(2H-tetrazol-5-yl)phenyl]-1,2,3,6-tetrahydropyridine;hydrochloride
CID 118995233
4-(4-tert-butylphenyl)-1-ethylpyrazole
CID 126653145
2-[4-(cyclopenten-1-yl)pyrazol-1-yl]ethanamine
CID 130563691
4-(1-ethylpyrazol-4-yl)-4-fluoropiperidine
CID 112563242
4-(2,5-dimethylpyrrolidin-3-yl)-1-ethylpyrazole
CID 103570829

Frequently Asked Questions

What is the IUPAC name of 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine?
The IUPAC name of 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine (CID 62800475) is 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine.
What is the SMILES notation for 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine?
The canonical SMILES for 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine is CCn1cc(C2=CCNCC2)cn1.
What is the InChIKey of 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine?
The InChIKey is YSULVVCXOFPCAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-2-13-8-10(7-12-13)9-3-5-11-6-4-9/h3,7-8,11H,2,4-6H2,1H3.
What are the key properties of 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine?
4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine has a molecular weight of 177.25 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-ethylpyrazol-4-yl)-1,2,3,6-tetrahydropyridine is sourced from PubChem (CID 62800475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).