4-(3-ethylpyrazol-1-yl)-1-methylpiperidine

C11H19N3 — CID 170573689

IUPAC4-(3-ethylpyrazol-1-yl)-1-methylpiperidine
SMILESCCc1ccn(C2CCN(C)CC2)n1
InChIInChI=1S/C11H19N3/c1-3-10-4-9-14(12-10)11-5-7-13(2)8-6-11/h4,9,11H,3,5-8H2,1-2H3
InChIKeyZNDDTGQVLLFPHF-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.71
Rot. Bonds2

About 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine

4-(3-ethylpyrazol-1-yl)-1-methylpiperidine (PubChem CID 170573689) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine.

Molecular Properties

Compound Name4-(3-ethylpyrazol-1-yl)-1-methylpiperidine
PubChem CID170573689
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC Name4-(3-ethylpyrazol-1-yl)-1-methylpiperidine
SMILESCCc1ccn(C2CCN(C)CC2)n1
InChIInChI=1S/C11H19N3/c1-3-10-4-9-14(12-10)11-5-7-13(2)8-6-11/h4,9,11H,3,5-8H2,1-2H3
InChIKeyZNDDTGQVLLFPHF-UHFFFAOYSA-N
XLogP1.71
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclohexyl-3-ethylpyrazole
CID 66014335
N-[(1-cyclopentylpyrazol-3-yl)methyl]butan-2-amine
CID 64801770
N-[(1-cyclopentylpyrazol-3-yl)methyl]-1-(4-ethylphenyl)methanamine
CID 103816376
1-(1-cyclopentylpyrazol-3-yl)butan-2-amine
CID 64785877
1-(2-chloroethyl)-4-[(1-cyclopentylpyrazol-3-yl)methyl]-1,4-diazepane
CID 64778323
2-[4-[(1-cyclopentylpyrazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanamine
CID 64801952
2-[4-[(1-cyclopentylpyrazol-3-yl)methyl]-1,4-diazepan-1-yl]ethanol
CID 64777495
1-(1-cyclohexylpyrazol-3-yl)butan-2-one
CID 64784110
3-(2-chloropropyl)-1-cyclopentylpyrazole
CID 130480485
1-[(1-cyclopentylpyrazol-3-yl)methyl]-N-ethylpiperidin-4-amine
CID 64801540
N-[(1-cyclopentylpyrazol-3-yl)methyl]-N-methyl-2-piperazin-1-ylethanamine
CID 64784047
1-(1-cyclopentylpyrazol-3-yl)-N-[(3-ethyl-1-methylpyrazol-4-yl)methyl]methanamine
CID 115885808

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine?
The IUPAC name of 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine (CID 170573689) is 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine.
What is the SMILES notation for 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine?
The canonical SMILES for 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine is CCc1ccn(C2CCN(C)CC2)n1.
What is the InChIKey of 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine?
The InChIKey is ZNDDTGQVLLFPHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-10-4-9-14(12-10)11-5-7-13(2)8-6-11/h4,9,11H,3,5-8H2,1-2H3.
What are the key properties of 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine?
4-(3-ethylpyrazol-1-yl)-1-methylpiperidine has a molecular weight of 193.29 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethylpyrazol-1-yl)-1-methylpiperidine is sourced from PubChem (CID 170573689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).