N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide

C11H24N4O2 — CID 54966179

IUPACN'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide
SMILESNC(CCCCN1CCN(CCO)CC1)=NO
InChIInChI=1S/C11H24N4O2/c12-11(13-17)3-1-2-4-14-5-7-15(8-6-14)9-10-16/h16-17H,1-10H2,(H2,12,13)
InChIKeyYWSHIIBFPCEJQD-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.49
Rot. Bonds7

About N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide

N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide (PubChem CID 54966179) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide
PubChem CID54966179
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC NameN'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide
SMILESNC(CCCCN1CCN(CCO)CC1)=NO
InChIInChI=1S/C11H24N4O2/c12-11(13-17)3-1-2-4-14-5-7-15(8-6-14)9-10-16/h16-17H,1-10H2,(H2,12,13)
InChIKeyYWSHIIBFPCEJQD-UHFFFAOYSA-N
XLogP-0.49
TPSA85.32 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'oxime_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide 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 N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide?
The IUPAC name of N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide (CID 54966179) is N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide.
What is the SMILES notation for N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide?
The canonical SMILES for N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide is NC(CCCCN1CCN(CCO)CC1)=NO.
What is the InChIKey of N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide?
The InChIKey is YWSHIIBFPCEJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c12-11(13-17)3-1-2-4-14-5-7-15(8-6-14)9-10-16/h16-17H,1-10H2,(H2,12,13).
What are the key properties of N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide?
N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide has a molecular weight of 244.34 g/mol, XLogP of -0.49, 7 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-[4-(2-hydroxyethyl)piperazin-1-yl]pentanimidamide is sourced from PubChem (CID 54966179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).