1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine

C11H20N4 — CID 25248518

IUPAC1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine
SMILESCCn1nc(C)cc1CN1CCNCC1
InChIInChI=1S/C11H20N4/c1-3-15-11(8-10(2)13-15)9-14-6-4-12-5-7-14/h8,12H,3-7,9H2,1-2H3
InChIKeyDHSCJLUFPXETDH-UHFFFAOYSA-N
MW208.31 g/mol
LogP0.62
Rot. Bonds3

About 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine

1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine (PubChem CID 25248518) has the molecular formula C11H20N4 and a molecular weight of 208.31 g/mol. Its IUPAC name is 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine.

Molecular Properties

Compound Name1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine
PubChem CID25248518
Molecular FormulaC11H20N4
Molecular Weight208.31 g/mol
Exact Mass208.17
IUPAC Name1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine
SMILESCCn1nc(C)cc1CN1CCNCC1
InChIInChI=1S/C11H20N4/c1-3-15-11(8-10(2)13-15)9-14-6-4-12-5-7-14/h8,12H,3-7,9H2,1-2H3
InChIKeyDHSCJLUFPXETDH-UHFFFAOYSA-N
XLogP0.62
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.31
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-4-methylpiperidin-4-ol
CID 81115265
[4-[(2-ethyl-5-methylpyrazol-3-yl)methyl]morpholin-2-yl]methanol
CID 81219626
1-[1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperidin-4-yl]pyrazol-3-amine
CID 107109996
5-(chloromethyl)-1-ethyl-3-methylpyrazole
CID 50896690
3-amino-1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]pyrrolidine-3-carboxylic acid
CID 107324856
2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-carboxamide
CID 66128465
1-ethyl-4-(piperazin-1-ylmethyl)pyrazol-5-amine
CID 117216696
2-ethyl-5-methyl-N-(2-piperazin-1-ylethyl)pyrazole-3-sulfonamide
CID 122565353
1-amino-3-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-1,3-diazinan-2-one
CID 113431479
[3-[(2-ethyl-5-methylpyrazol-3-yl)methyl]pyrrolidin-3-yl]methanol
CID 66058384
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]-3,3-dimethylcyclopentan-1-amine
CID 80705915
1-[(1-ethylpyrrol-2-yl)methyl]piperazine
CID 82505182

Frequently Asked Questions

What is the IUPAC name of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine?
The IUPAC name of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine (CID 25248518) is 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine.
What is the SMILES notation for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine?
The canonical SMILES for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine is CCn1nc(C)cc1CN1CCNCC1.
What is the InChIKey of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine?
The InChIKey is DHSCJLUFPXETDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4/c1-3-15-11(8-10(2)13-15)9-14-6-4-12-5-7-14/h8,12H,3-7,9H2,1-2H3.
What are the key properties of 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine?
1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine has a molecular weight of 208.31 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-ethyl-5-methylpyrazol-3-yl)methyl]piperazine is sourced from PubChem (CID 25248518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).