5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide

C8H19N3O — CID 109374551

IUPAC5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide
SMILESCCN(C)CCCC/C(N)=N/O
InChIInChI=1S/C8H19N3O/c1-3-11(2)7-5-4-6-8(9)10-12/h12H,3-7H2,1-2H3,(H2,9,10)
InChIKeyWSQPHTKJQNKEIM-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.85
Rot. Bonds6

About 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide

5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide (PubChem CID 109374551) has the molecular formula C8H19N3O and a molecular weight of 173.26 g/mol. Its IUPAC name is 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide.

Molecular Properties

Compound Name5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide
PubChem CID109374551
Molecular FormulaC8H19N3O
Molecular Weight173.26 g/mol
Exact Mass173.15
IUPAC Name5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide
SMILESCCN(C)CCCC/C(N)=N/O
InChIInChI=1S/C8H19N3O/c1-3-11(2)7-5-4-6-8(9)10-12/h12H,3-7H2,1-2H3,(H2,9,10)
InChIKeyWSQPHTKJQNKEIM-UHFFFAOYSA-N
XLogP0.85
TPSA61.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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'}

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Related Compounds

5-[2,2-dimethylpropyl(methyl)amino]-N'-hydroxypentanimidamide
CID 76928038
N'-hydroxy-3-[methyl(octyl)amino]propanimidamide
CID 43129496
4-(dimethylamino)-N'-hydroxybutanimidamide
CID 74314081
5-[cyclopropyl(ethyl)amino]-N'-hydroxypentanimidamide
CID 109374552
N'-hydroxy-4-[methyl(2-methylbutyl)amino]butanimidamide
CID 43295873
N'-hydroxy-5-[methyl(oxan-4-ylmethyl)amino]pentanimidamide
CID 76951572
5-[butyl(2-hydroxyethyl)amino]-N'-hydroxypentanimidamide
CID 109374620
N'-hydroxy-4-[3-hydroxybutyl(methyl)amino]butanimidamide
CID 104869240
5-[2-(diethylamino)ethylamino]-N'-hydroxypentanimidamide
CID 77026354
N'-hydroxy-5-[2-hydroxyethyl(propyl)amino]pentanimidamide
CID 109374606
N'-hydroxy-5-[methyl-(2-methylcyclohexyl)amino]pentanimidamide
CID 55005421
5-[3,3-dimethylbutan-2-yl(methyl)amino]-N'-hydroxypentanimidamide
CID 76912512

Frequently Asked Questions

What is the IUPAC name of 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide?
The IUPAC name of 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide (CID 109374551) is 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide.
What is the SMILES notation for 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide?
The canonical SMILES for 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide is CCN(C)CCCC/C(N)=N/O.
What is the InChIKey of 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide?
The InChIKey is WSQPHTKJQNKEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19N3O/c1-3-11(2)7-5-4-6-8(9)10-12/h12H,3-7H2,1-2H3,(H2,9,10).
What are the key properties of 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide?
5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide has a molecular weight of 173.26 g/mol, XLogP of 0.85, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[ethyl(methyl)amino]-N'-hydroxypentanimidamide is sourced from PubChem (CID 109374551), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).