2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol

C10H17ClN6O — CID 80906441

IUPAC2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESNNc1ncc(Cl)c(N2CCN(CCO)CC2)n1
InChIInChI=1S/C10H17ClN6O/c11-8-7-13-10(15-12)14-9(8)17-3-1-16(2-4-17)5-6-18/h7,18H,1-6,12H2,(H,13,14,15)
InChIKeyHBQZVFNVZKBVSG-UHFFFAOYSA-N
MW272.74 g/mol
LogP-0.47
Rot. Bonds4

About 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol

2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol (PubChem CID 80906441) has the molecular formula C10H17ClN6O and a molecular weight of 272.74 g/mol. Its IUPAC name is 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol.

Molecular Properties

Compound Name2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol
PubChem CID80906441
Molecular FormulaC10H17ClN6O
Molecular Weight272.74 g/mol
Exact Mass272.12
IUPAC Name2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol
SMILESNNc1ncc(Cl)c(N2CCN(CCO)CC2)n1
InChIInChI=1S/C10H17ClN6O/c11-8-7-13-10(15-12)14-9(8)17-3-1-16(2-4-17)5-6-18/h7,18H,1-6,12H2,(H,13,14,15)
InChIKeyHBQZVFNVZKBVSG-UHFFFAOYSA-N
XLogP-0.47
TPSA90.54 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.74
LogP ≤ 5-0.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol 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-(5-fluoro-2-hydrazinylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanol
CID 107226856
[4-(azetidin-1-yl)-5-chloropyrimidin-2-yl]hydrazine
CID 130548753
[4-(azocan-1-yl)-5-chloropyrimidin-2-yl]hydrazine
CID 80932155
1-(5-chloro-2-hydrazinylpyrimidin-4-yl)pyrrolidine-3,4-diol
CID 106674652
2-[4-(2-hydrazinylquinazolin-4-yl)piperazin-1-yl]ethanol
CID 80898065
[5-chloro-4-(3,4,5-trimethylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 114542250
2-[4-(2-hydrazinylpyrimidin-4-yl)-1,4-diazepan-1-yl]ethanol
CID 107226843
2-[4-(5-amino-6-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol
CID 19140663
[5-bromo-4-(4-ethylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80928369
1-(5-chloro-2-hydrazinylpyrimidin-4-yl)-N,N-dimethylpyrrolidin-3-amine
CID 80914551
5-chloro-6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridine-3-carboxylic acid
CID 43592266
[5-fluoro-4-(4-methylpiperazin-1-yl)pyrimidin-2-yl]hydrazine
CID 80927536

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The IUPAC name of 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol (CID 80906441) is 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol.
What is the SMILES notation for 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The canonical SMILES for 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol is NNc1ncc(Cl)c(N2CCN(CCO)CC2)n1.
What is the InChIKey of 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol?
The InChIKey is HBQZVFNVZKBVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17ClN6O/c11-8-7-13-10(15-12)14-9(8)17-3-1-16(2-4-17)5-6-18/h7,18H,1-6,12H2,(H,13,14,15).
What are the key properties of 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol?
2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol has a molecular weight of 272.74 g/mol, XLogP of -0.47, 4 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-chloro-2-hydrazinylpyrimidin-4-yl)piperazin-1-yl]ethanol is sourced from PubChem (CID 80906441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).