2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one

C10H16N4O — CID 82470560

IUPAC2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one
SMILESO=c1ccnc(CCN2CCNCC2)[nH]1
InChIInChI=1S/C10H16N4O/c15-10-1-3-12-9(13-10)2-6-14-7-4-11-5-8-14/h1,3,11H,2,4-8H2,(H,12,13,15)
InChIKeyBPKSKKOQMMYRDQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP-0.78
Rot. Bonds3

About 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one

2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one (PubChem CID 82470560) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one.

Molecular Properties

Compound Name2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one
PubChem CID82470560
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one
SMILESO=c1ccnc(CCN2CCNCC2)[nH]1
InChIInChI=1S/C10H16N4O/c15-10-1-3-12-9(13-10)2-6-14-7-4-11-5-8-14/h1,3,11H,2,4-8H2,(H,12,13,15)
InChIKeyBPKSKKOQMMYRDQ-UHFFFAOYSA-N
XLogP-0.78
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 5-0.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one with MolForge

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

Launch Full Analysis

Related Compounds

2-[(4-Methyl-1-piperazinyl)methyl]-4(3h)-pyrimidinone
CID 67216931
6,7,8,9-Tetrahydro-4H-pyrazino[1,2-a]pyrimidin-4-one
CID 83681515
7,8,9,10-tetrahydro-6H-pyrimido[1,2-d][1,4]diazepin-4-one
CID 123675992
2-[4-(1,4-diazepan-1-yl)butyl]-1H-pyrimidin-6-one
CID 139830068
2-[2-(diethylamino)ethyl]-1H-pyrimidin-6-one
CID 43654586
3-(3-Oxo-3-piperazin-1-ylpropyl)pyrimidin-4-one
CID 55237815
2-piperidin-2-yl-1H-pyrimidin-6-one
CID 63362648
2-(piperazin-1-ylmethyl)-1H-pyrimidin-6-one
CID 63362903
2-(1-piperazin-1-ylethyl)-1H-pyrimidin-6-one
CID 63362941
2-(1-piperazin-1-ylpropyl)-1H-pyrimidin-6-one
CID 63362942
2-(1-piperazin-1-ylbutyl)-1H-pyrimidin-6-one
CID 63362943
2-(2-piperazin-1-ylpropan-2-yl)-1H-pyrimidin-6-one
CID 63362944

Frequently Asked Questions

What is the IUPAC name of 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one?
The IUPAC name of 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one (CID 82470560) is 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one.
What is the SMILES notation for 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one?
The canonical SMILES for 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one is O=c1ccnc(CCN2CCNCC2)[nH]1.
What is the InChIKey of 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one?
The InChIKey is BPKSKKOQMMYRDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c15-10-1-3-12-9(13-10)2-6-14-7-4-11-5-8-14/h1,3,11H,2,4-8H2,(H,12,13,15).
What are the key properties of 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one?
2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one has a molecular weight of 208.26 g/mol, XLogP of -0.78, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-piperazin-1-ylethyl)-1H-pyrimidin-6-one is sourced from PubChem (CID 82470560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).