2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone

C10H19N5O — CID 129270082

IUPAC2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone
SMILESCN1CCN(C(=O)CN2C=C(N)CN2)CC1
InChIInChI=1S/C10H19N5O/c1-13-2-4-14(5-3-13)10(16)8-15-7-9(11)6-12-15/h7,12H,2-6,8,11H2,1H3
InChIKeySYXMIHUROOUCFD-UHFFFAOYSA-N
MW225.30 g/mol
LogP-1.62
Rot. Bonds2

About 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone

2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone (PubChem CID 129270082) has the molecular formula C10H19N5O and a molecular weight of 225.30 g/mol. Its IUPAC name is 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone.

Molecular Properties

Compound Name2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone
PubChem CID129270082
Molecular FormulaC10H19N5O
Molecular Weight225.30 g/mol
Exact Mass225.16
IUPAC Name2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone
SMILESCN1CCN(C(=O)CN2C=C(N)CN2)CC1
InChIInChI=1S/C10H19N5O/c1-13-2-4-14(5-3-13)10(16)8-15-7-9(11)6-12-15/h7,12H,2-6,8,11H2,1H3
InChIKeySYXMIHUROOUCFD-UHFFFAOYSA-N
XLogP-1.62
TPSA64.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 5-1.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The IUPAC name of 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone (CID 129270082) is 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone.
What is the SMILES notation for 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The canonical SMILES for 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone is CN1CCN(C(=O)CN2C=C(N)CN2)CC1.
What is the InChIKey of 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone?
The InChIKey is SYXMIHUROOUCFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N5O/c1-13-2-4-14(5-3-13)10(16)8-15-7-9(11)6-12-15/h7,12H,2-6,8,11H2,1H3.
What are the key properties of 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone?
2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone has a molecular weight of 225.30 g/mol, XLogP of -1.62, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-1,5-dihydropyrazol-2-yl)-1-(4-methylpiperazin-1-yl)ethanone is sourced from PubChem (CID 129270082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).