1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine

C11H19N3O — CID 51104409

IUPAC1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine
SMILESCOCCN1CCC(c2ccn[nH]2)CC1
InChIInChI=1S/C11H19N3O/c1-15-9-8-14-6-3-10(4-7-14)11-2-5-12-13-11/h2,5,10H,3-4,6-9H2,1H3,(H,12,13)
InChIKeyNARULFLVLPRYBB-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.24
Rot. Bonds4

About 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine

1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine (PubChem CID 51104409) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine.

Molecular Properties

Compound Name1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine
PubChem CID51104409
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine
SMILESCOCCN1CCC(c2ccn[nH]2)CC1
InChIInChI=1S/C11H19N3O/c1-15-9-8-14-6-3-10(4-7-14)11-2-5-12-13-11/h2,5,10H,3-4,6-9H2,1H3,(H,12,13)
InChIKeyNARULFLVLPRYBB-UHFFFAOYSA-N
XLogP1.24
TPSA41.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(1H-Pyrazol-5-yl)piperidine
CID 21193114
3-(1H-pyrazol-5-yl)piperidine
CID 42961301
4-(1H-pyrazol-5-ylmethyl)piperidine
CID 75355610
US10030012, Example 6
CID 78318738
3-(1H-pyrazol-5-yl)piperidine dihydrochloride
CID 42961300
tert-butyl 3-(1H-pyrazol-3-yl)piperidine-1-carboxylate
CID 63787659
tert-butyl 4-(1H-pyrazol-3-yl)piperidine-1-carboxylate
CID 68817960
5-(oxan-4-yl)-1H-pyrazole
CID 90029737
N-[(5-tert-butyl-1H-pyrazol-4-yl)methyl]-1-[1-(2-methoxyethyl)piperidin-4-yl]methanamine
CID 71879887
5-(1-cyclohexylpyrrolidin-3-yl)-1H-pyrazole
CID 73440312
2-[2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanol
CID 73440323
2-methyl-1-[4-methyl-4-(1H-pyrazol-5-yl)piperidin-1-yl]propan-1-one
CID 73440518

Frequently Asked Questions

What is the IUPAC name of 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine?
The IUPAC name of 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine (CID 51104409) is 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine.
What is the SMILES notation for 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine?
The canonical SMILES for 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine is COCCN1CCC(c2ccn[nH]2)CC1.
What is the InChIKey of 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine?
The InChIKey is NARULFLVLPRYBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-15-9-8-14-6-3-10(4-7-14)11-2-5-12-13-11/h2,5,10H,3-4,6-9H2,1H3,(H,12,13).
What are the key properties of 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine?
1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine has a molecular weight of 209.29 g/mol, XLogP of 1.24, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyethyl)-4-(1H-pyrazol-5-yl)piperidine is sourced from PubChem (CID 51104409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).