1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone

C10H16N4O — CID 60712105

IUPAC1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone
SMILESCN1CCN(C(=O)Cn2cccn2)CC1
InChIInChI=1S/C10H16N4O/c1-12-5-7-13(8-6-12)10(15)9-14-4-2-3-11-14/h2-4H,5-9H2,1H3
InChIKeyUHCDJVAUWNJJEM-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.34
Rot. Bonds2

About 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone

1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone (PubChem CID 60712105) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone
PubChem CID60712105
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone
SMILESCN1CCN(C(=O)Cn2cccn2)CC1
InChIInChI=1S/C10H16N4O/c1-12-5-7-13(8-6-12)10(15)9-14-4-2-3-11-14/h2-4H,5-9H2,1H3
InChIKeyUHCDJVAUWNJJEM-UHFFFAOYSA-N
XLogP-0.34
TPSA41.37 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone?
The IUPAC name of 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone (CID 60712105) is 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone is CN1CCN(C(=O)Cn2cccn2)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone?
The InChIKey is UHCDJVAUWNJJEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-12-5-7-13(8-6-12)10(15)9-14-4-2-3-11-14/h2-4H,5-9H2,1H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone?
1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone has a molecular weight of 208.26 g/mol, XLogP of -0.34, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)-2-pyrazol-1-ylethanone is sourced from PubChem (CID 60712105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).