4-(2-butoxyethoxy)-N'-hydroxybutanimidamide

C10H22N2O3 — CID 43128368

IUPAC4-(2-butoxyethoxy)-N'-hydroxybutanimidamide
SMILESCCCCOCCOCCC/C(N)=N/O
InChIInChI=1S/C10H22N2O3/c1-2-3-6-14-8-9-15-7-4-5-10(11)12-13/h13H,2-9H2,1H3,(H2,11,12)
InChIKeyVPKJSFMEWIHUBV-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.35
Rot. Bonds10

About 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide

4-(2-butoxyethoxy)-N'-hydroxybutanimidamide (PubChem CID 43128368) has the molecular formula C10H22N2O3 and a molecular weight of 218.30 g/mol. Its IUPAC name is 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide.

Molecular Properties

Compound Name4-(2-butoxyethoxy)-N'-hydroxybutanimidamide
PubChem CID43128368
Molecular FormulaC10H22N2O3
Molecular Weight218.30 g/mol
Exact Mass218.16
IUPAC Name4-(2-butoxyethoxy)-N'-hydroxybutanimidamide
SMILESCCCCOCCOCCC/C(N)=N/O
InChIInChI=1S/C10H22N2O3/c1-2-3-6-14-8-9-15-7-4-5-10(11)12-13/h13H,2-9H2,1H3,(H2,11,12)
InChIKeyVPKJSFMEWIHUBV-UHFFFAOYSA-N
XLogP1.35
TPSA77.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.35
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'}

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Related Compounds

N'-hydroxy-4-methoxybutanimidamide
CID 24697443
CID 24699305
CID 24699305
(1Z)-N'-hydroxy-4-methoxybutanimidamide
CID 28188006
CID 57363835
CID 57363835
4-ethoxy-N'-hydroxy-5-methoxypentanimidamide
CID 58478330
3-(2-ethoxyethoxy)-N'-hydroxypropanimidamide
CID 74313832
4-ethoxy-N'-hydroxy-5-methoxypentanimidamide
CID 76798780
ethane;N'-(2-ethoxyethoxy)ethanimidamide
CID 144988529
N'-hydroxy-3-(2-methoxyethoxy)propanimidamide
CID 24692189
N'-hydroxy-3-(2-propan-2-yloxyethoxy)propanimidamide
CID 24692470
N'-hydroxy-4-propan-2-yloxybutanimidamide
CID 24692714
4-(2-ethoxyethoxy)-N'-hydroxybutanimidamide
CID 24693081

Frequently Asked Questions

What is the IUPAC name of 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide?
The IUPAC name of 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide (CID 43128368) is 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide.
What is the SMILES notation for 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide?
The canonical SMILES for 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide is CCCCOCCOCCC/C(N)=N/O.
What is the InChIKey of 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide?
The InChIKey is VPKJSFMEWIHUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O3/c1-2-3-6-14-8-9-15-7-4-5-10(11)12-13/h13H,2-9H2,1H3,(H2,11,12).
What are the key properties of 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide?
4-(2-butoxyethoxy)-N'-hydroxybutanimidamide has a molecular weight of 218.30 g/mol, XLogP of 1.35, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-butoxyethoxy)-N'-hydroxybutanimidamide is sourced from PubChem (CID 43128368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).