5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide

C9H21N3O2 — CID 77027141

IUPAC5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide
SMILESCCOCCNCCCCC(N)=NO
InChIInChI=1S/C9H21N3O2/c1-2-14-8-7-11-6-4-3-5-9(10)12-13/h11,13H,2-8H2,1H3,(H2,10,12)
InChIKeyDDOKPOWDTISDCR-UHFFFAOYSA-N
MW203.29 g/mol
LogP0.53
Rot. Bonds9

About 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide

5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide (PubChem CID 77027141) has the molecular formula C9H21N3O2 and a molecular weight of 203.29 g/mol. Its IUPAC name is 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide
PubChem CID77027141
Molecular FormulaC9H21N3O2
Molecular Weight203.29 g/mol
Exact Mass203.16
IUPAC Name5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide
SMILESCCOCCNCCCCC(N)=NO
InChIInChI=1S/C9H21N3O2/c1-2-14-8-7-11-6-4-3-5-9(10)12-13/h11,13H,2-8H2,1H3,(H2,10,12)
InChIKeyDDOKPOWDTISDCR-UHFFFAOYSA-N
XLogP0.53
TPSA79.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 50.53
H-Bond Donors ≤ 53
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 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide 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

5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide
CID 77025981
5-(2-butoxyethylamino)-N'-hydroxypentanimidamide
CID 77030771
2-[2-[(5-amino-5-hydroxyiminopentyl)amino]ethoxy]acetamide
CID 106237637
N'-hydroxy-5-(2-methylsulfanylethylamino)pentanimidamide
CID 77027857
5-[2-(diethylamino)ethylamino]-N'-hydroxypentanimidamide
CID 77026354
N'-hydroxy-5-(3-hydroxypropylamino)pentanimidamide
CID 77028808
N'-hydroxy-4-(3-methoxypropylamino)butanimidamide
CID 77027942
4-ethoxy-N-(2-ethoxyethyl)butan-1-amine
CID 62565193
5-[2-[2-(2-ethoxyethoxy)ethoxy]ethylamino]pentanoic acid
CID 175739046
N'-hydroxy-5-(prop-2-ynylamino)pentanimidamide
CID 77026148
4-ethoxy-N-[2-(2-ethoxyethoxy)ethyl]butan-1-amine
CID 62565012
N'-hydroxy-5-(2-methylbutylamino)pentanimidamide
CID 77027184

Frequently Asked Questions

What is the IUPAC name of 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide?
The IUPAC name of 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide (CID 77027141) is 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide?
The canonical SMILES for 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide is CCOCCNCCCCC(N)=NO.
What is the InChIKey of 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide?
The InChIKey is DDOKPOWDTISDCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3O2/c1-2-14-8-7-11-6-4-3-5-9(10)12-13/h11,13H,2-8H2,1H3,(H2,10,12).
What are the key properties of 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide?
5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide has a molecular weight of 203.29 g/mol, XLogP of 0.53, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-ethoxyethylamino)-N'-hydroxypentanimidamide is sourced from PubChem (CID 77027141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).