1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine

C11H20N4 — CID 117124669

IUPAC1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine
SMILESCCn1nc(C)c(N2CCNCC2)c1C
InChIInChI=1S/C11H20N4/c1-4-15-10(3)11(9(2)13-15)14-7-5-12-6-8-14/h12H,4-8H2,1-3H3
InChIKeyVJEHVISDQKFSTE-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.93
Rot. Bonds2

About 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine

1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine (PubChem CID 117124669) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine.

Molecular Properties

Compound Name1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine
PubChem CID117124669
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine
SMILESCCn1nc(C)c(N2CCNCC2)c1C
InChIInChI=1S/C11H20N4/c1-4-15-10(3)11(9(2)13-15)14-7-5-12-6-8-14/h12H,4-8H2,1-3H3
InChIKeyVJEHVISDQKFSTE-UHFFFAOYSA-N
XLogP0.93
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(1-ethyl-3,5-dimethylpyrazol-4-yl)ethyl]piperazine
CID 23005910
1-(1-cyclopentyl-3,5-dimethylpyrazol-4-yl)piperazine
CID 117124667
2-(3,5-dimethyl-4-piperazin-1-ylpyrazol-1-yl)phenol
CID 117124655
2-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-2,8-diazaspiro[4.5]decane;hydrochloride
CID 120906461
1-ethyl-4-iodo-3,5-dimethylpyrazole
CID 51063680
1-(3,5-dimethyl-4-pyridinyl)piperazine
CID 75355584
N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-4-fluoropiperidine-4-carboxamide
CID 167870261
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine
CID 25248518
1-ethyl-3,5-dimethyl-4-[(2R)-pyrrolidin-2-yl]pyrazole
CID 99978633
(1-ethyl-5-methyltriazol-4-yl)-piperazin-1-ylmethanone
CID 82509564
4-[(4-chloro-1-ethyl-3-methylpyrazol-5-yl)methylidene]piperidine
CID 79880289
4-(chloromethyl)-1-ethyl-3,5-dimethylpyrazole
CID 43648133

Frequently Asked Questions

What is the IUPAC name of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine?
The IUPAC name of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine (CID 117124669) is 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine.
What is the SMILES notation for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine?
The canonical SMILES for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine is CCn1nc(C)c(N2CCNCC2)c1C.
What is the InChIKey of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine?
The InChIKey is VJEHVISDQKFSTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-4-15-10(3)11(9(2)13-15)14-7-5-12-6-8-14/h12H,4-8H2,1-3H3.
What are the key properties of 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine?
1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine has a molecular weight of 208.31 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-ethyl-3,5-dimethylpyrazol-4-yl)piperazine is sourced from PubChem (CID 117124669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).