5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide

C10H23N3O2 — CID 77025981

IUPAC5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide
SMILESCCOCCCNCCCCC(N)=NO
InChIInChI=1S/C10H23N3O2/c1-2-15-9-5-8-12-7-4-3-6-10(11)13-14/h12,14H,2-9H2,1H3,(H2,11,13)
InChIKeyISLYJMFMMFURQE-UHFFFAOYSA-N
MW217.31 g/mol
LogP0.92
Rot. Bonds10

About 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide

5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide (PubChem CID 77025981) has the molecular formula C10H23N3O2 and a molecular weight of 217.31 g/mol. Its IUPAC name is 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide
PubChem CID77025981
Molecular FormulaC10H23N3O2
Molecular Weight217.31 g/mol
Exact Mass217.18
IUPAC Name5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide
SMILESCCOCCCNCCCCC(N)=NO
InChIInChI=1S/C10H23N3O2/c1-2-15-9-5-8-12-7-4-3-6-10(11)13-14/h12,14H,2-9H2,1H3,(H2,11,13)
InChIKeyISLYJMFMMFURQE-UHFFFAOYSA-N
XLogP0.92
TPSA79.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 50.92
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-(3-ethoxypropylamino)-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-(2-ethoxyethylamino)-N'-hydroxypentanimidamide
CID 77027141
5-(2-butoxyethylamino)-N'-hydroxypentanimidamide
CID 77030771
N'-hydroxy-4-(3-methoxypropylamino)butanimidamide
CID 77027942
5-[2-(diethylamino)ethylamino]-N'-hydroxypentanimidamide
CID 77026354
N'-hydroxy-5-(3-hydroxypropylamino)pentanimidamide
CID 77028808
2-[2-[(5-amino-5-hydroxyiminopentyl)amino]ethoxy]acetamide
CID 106237637
5-butoxy-N'-hydroxypentanimidamide
CID 109374755
N'-hydroxy-5-(2-methylsulfanylethylamino)pentanimidamide
CID 77027857
5-(2-cyclopropylethylamino)-N'-hydroxypentanimidamide
CID 77072404
N'-hydroxy-5-(prop-2-ynylamino)pentanimidamide
CID 77026148
N'-hydroxy-5-(2-methylbutylamino)pentanimidamide
CID 77027184
N'-hydroxy-5-[(2-hydroxy-3-methoxypropyl)amino]pentanimidamide
CID 77030580

Frequently Asked Questions

What is the IUPAC name of 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide?
The IUPAC name of 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide (CID 77025981) is 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide?
The canonical SMILES for 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide is CCOCCCNCCCCC(N)=NO.
What is the InChIKey of 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide?
The InChIKey is ISLYJMFMMFURQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O2/c1-2-15-9-5-8-12-7-4-3-6-10(11)13-14/h12,14H,2-9H2,1H3,(H2,11,13).
What are the key properties of 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide?
5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide has a molecular weight of 217.31 g/mol, XLogP of 0.92, 10 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-ethoxypropylamino)-N'-hydroxypentanimidamide is sourced from PubChem (CID 77025981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).