N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide

C12H26N4O — CID 104937397

IUPACN'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide
SMILESCC1CN(CCCCC(N)=NO)CC(C)N1C
InChIInChI=1S/C12H26N4O/c1-10-8-16(9-11(2)15(10)3)7-5-4-6-12(13)14-17/h10-11,17H,4-9H2,1-3H3,(H2,13,14)
InChIKeyRWMKWVZPLJIDTQ-UHFFFAOYSA-N
MW242.37 g/mol
LogP0.93
Rot. Bonds5

About N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide

N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide (PubChem CID 104937397) has the molecular formula C12H26N4O and a molecular weight of 242.37 g/mol. Its IUPAC name is N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide.

Molecular Properties

Compound NameN'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide
PubChem CID104937397
Molecular FormulaC12H26N4O
Molecular Weight242.37 g/mol
Exact Mass242.21
IUPAC NameN'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide
SMILESCC1CN(CCCCC(N)=NO)CC(C)N1C
InChIInChI=1S/C12H26N4O/c1-10-8-16(9-11(2)15(10)3)7-5-4-6-12(13)14-17/h10-11,17H,4-9H2,1-3H3,(H2,13,14)
InChIKeyRWMKWVZPLJIDTQ-UHFFFAOYSA-N
XLogP0.93
TPSA65.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.37
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(3,4,5-trimethylpiperazin-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

Related Compounds

4-(2,6-dimethylmorpholin-4-yl)-N'-hydroxybutanimidamide
CID 24710363
4-(4-ethyl-3-methylpiperazin-1-yl)-N'-hydroxybutanimidamide
CID 77000710
N'-hydroxy-5-[4-(2-methylpropyl)piperazin-1-yl]pentanimidamide
CID 76949002
N'-hydroxy-5-(2-methyl-1,4-oxazepan-4-yl)pentanimidamide
CID 76979643
N'-hydroxy-5-piperidin-1-ylpentanimidamide
CID 6015018
N'-hydroxy-5-(3-methoxy-4-methylpiperidin-1-yl)pentanimidamide
CID 102958343
3-(3,5-dimethylpiperidin-1-yl)-N'-hydroxypropanimidamide
CID 24694035
N'-hydroxy-5-(2-methylpiperidin-1-yl)pentanimidamide
CID 109374519
N'-hydroxy-4-(4-methylpiperazin-1-yl)butanimidamide
CID 24689656
N'-hydroxy-5-[4-(methoxymethyl)piperidin-1-yl]pentanimidamide
CID 63972125
N'-hydroxy-3-[propan-2-yl(3-pyrrolidin-1-ylpropyl)amino]propanimidamide
CID 54998200
4-(2,6-dimethylpiperidin-1-yl)-N'-hydroxybutanimidamide
CID 24711265

Frequently Asked Questions

What is the IUPAC name of N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide?
The IUPAC name of N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide (CID 104937397) is N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide.
What is the SMILES notation for N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide?
The canonical SMILES for N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide is CC1CN(CCCCC(N)=NO)CC(C)N1C.
What is the InChIKey of N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide?
The InChIKey is RWMKWVZPLJIDTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N4O/c1-10-8-16(9-11(2)15(10)3)7-5-4-6-12(13)14-17/h10-11,17H,4-9H2,1-3H3,(H2,13,14).
What are the key properties of N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide?
N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide has a molecular weight of 242.37 g/mol, XLogP of 0.93, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-hydroxy-5-(3,4,5-trimethylpiperazin-1-yl)pentanimidamide is sourced from PubChem (CID 104937397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).