1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine

C10H18N4 — CID 174436389

IUPAC1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine
SMILESCc1nn(C)cc1N1CCN(C)CC1
InChIInChI=1S/C10H18N4/c1-9-10(8-13(3)11-9)14-6-4-12(2)5-7-14/h8H,4-7H2,1-3H3
InChIKeyNEIXVEGBDOFZDY-UHFFFAOYSA-N
MW194.28 g/mol
LogP0.48
Rot. Bonds1

About 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine

1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine (PubChem CID 174436389) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine
PubChem CID174436389
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine
SMILESCc1nn(C)cc1N1CCN(C)CC1
InChIInChI=1S/C10H18N4/c1-9-10(8-13(3)11-9)14-6-4-12(2)5-7-14/h8H,4-7H2,1-3H3
InChIKeyNEIXVEGBDOFZDY-UHFFFAOYSA-N
XLogP0.48
TPSA24.30 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 50.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine?
The IUPAC name of 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine (CID 174436389) is 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine.
What is the SMILES notation for 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine?
The canonical SMILES for 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine is Cc1nn(C)cc1N1CCN(C)CC1.
What is the InChIKey of 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine?
The InChIKey is NEIXVEGBDOFZDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-9-10(8-13(3)11-9)14-6-4-12(2)5-7-14/h8H,4-7H2,1-3H3.
What are the key properties of 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine?
1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine has a molecular weight of 194.28 g/mol, XLogP of 0.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,3-dimethylpyrazol-4-yl)-4-methylpiperazine is sourced from PubChem (CID 174436389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).