(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine

C13H24N4 — CID 82755426

IUPAC(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
SMILESCCc1cc(CN2CCNC[C@H]2C)n(CC)n1
InChIInChI=1S/C13H24N4/c1-4-12-8-13(17(5-2)15-12)10-16-7-6-14-9-11(16)3/h8,11,14H,4-7,9-10H2,1-3H3/t11-/m1/s1
InChIKeySUMOTHKGVJIJCH-LLVKDONJSA-N
MW236.36 g/mol
LogP1.26
Rot. Bonds4

About (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine

(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine (PubChem CID 82755426) has the molecular formula C13H24N4 and a molecular weight of 236.36 g/mol. Its IUPAC name is (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine.

Molecular Properties

Compound Name(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
PubChem CID82755426
Molecular FormulaC13H24N4
Molecular Weight236.36 g/mol
Exact Mass236.20
IUPAC Name(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
SMILESCCc1cc(CN2CCNC[C@H]2C)n(CC)n1
InChIInChI=1S/C13H24N4/c1-4-12-8-13(17(5-2)15-12)10-16-7-6-14-9-11(16)3/h8,11,14H,4-7,9-10H2,1-3H3/t11-/m1/s1
InChIKeySUMOTHKGVJIJCH-LLVKDONJSA-N
XLogP1.26
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R)-1-[(4-bromo-1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine
CID 82761869
4-ethyl-2-[[(2R)-2-methylpiperazin-1-yl]methyl]-1H-pyrimidin-6-one
CID 137078249
(2R)-1-[(4-chloro-1-ethyl-3-methylpyrazol-5-yl)methyl]-2-methylpiperazine
CID 82755521
2-ethyl-5-[[(2R)-2-methylpiperazin-1-yl]methyl]-1,3,4-oxadiazole
CID 82756029
(2S)-2-methyl-1-[(3-propan-2-ylimidazol-4-yl)methyl]piperazine
CID 82756307
(2R)-2-methyl-1-[(2-methyltriazol-4-yl)methyl]piperazine
CID 130591920
ethane;(2S)-1-ethyl-2-methylpiperazine
CID 154651366
1-[(1,3-diethylpyrazol-5-yl)methyl]piperazine-2,6-dione
CID 66062447
(2R)-2-methyl-1-[(1-methyltriazol-4-yl)methyl]piperazine
CID 104869459
2-(bromomethyl)-1-[(1,3-diethylpyrazol-5-yl)methyl]azepane
CID 116638458
(2R)-1-[(1-ethylimidazol-2-yl)methyl]-2-methylpiperazine
CID 82761036
3-ethyl-5-[[(2S)-2-methylpiperazin-1-yl]methyl]-1,2,4-oxadiazole
CID 82705500

Frequently Asked Questions

What is the IUPAC name of (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine?
The IUPAC name of (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine (CID 82755426) is (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine.
What is the SMILES notation for (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine?
The canonical SMILES for (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine is CCc1cc(CN2CCNC[C@H]2C)n(CC)n1.
What is the InChIKey of (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine?
The InChIKey is SUMOTHKGVJIJCH-LLVKDONJSA-N. The full InChI is InChI=1S/C13H24N4/c1-4-12-8-13(17(5-2)15-12)10-16-7-6-14-9-11(16)3/h8,11,14H,4-7,9-10H2,1-3H3/t11-/m1/s1.
What are the key properties of (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine?
(2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine has a molecular weight of 236.36 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-[(1,3-diethylpyrazol-5-yl)methyl]-2-methylpiperazine is sourced from PubChem (CID 82755426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).