2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide

C10H23N3O3 — CID 103409988

IUPAC2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide
SMILESCCN(CCCOCCOC)CC(N)=NO
InChIInChI=1S/C10H23N3O3/c1-3-13(9-10(11)12-14)5-4-6-16-8-7-15-2/h14H,3-9H2,1-2H3,(H2,11,12)
InChIKeyJAIXAQXKSRAFKP-UHFFFAOYSA-N
MW233.31 g/mol
LogP0.11
Rot. Bonds10

About 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide

2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide (PubChem CID 103409988) has the molecular formula C10H23N3O3 and a molecular weight of 233.31 g/mol. Its IUPAC name is 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide.

Molecular Properties

Compound Name2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide
PubChem CID103409988
Molecular FormulaC10H23N3O3
Molecular Weight233.31 g/mol
Exact Mass233.17
IUPAC Name2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide
SMILESCCN(CCCOCCOC)CC(N)=NO
InChIInChI=1S/C10H23N3O3/c1-3-13(9-10(11)12-14)5-4-6-16-8-7-15-2/h14H,3-9H2,1-2H3,(H2,11,12)
InChIKeyJAIXAQXKSRAFKP-UHFFFAOYSA-N
XLogP0.11
TPSA80.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-2-[3-(2-methoxyethoxy)propyl-propan-2-ylamino]ethanimidamide
CID 103410003
3-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxy-2-methylpropanimidamide
CID 103409983
2-[bis(2-methoxyethyl)amino]-N'-hydroxyethanimidamide
CID 60661910
3-[ethyl-[3-(2-methoxyethoxy)propyl]amino]propanethioamide
CID 103409810
N'-hydroxy-2-[2-methoxyethyl(propyl)amino]ethanimidamide
CID 76927566
2-[2-butoxyethyl(propyl)amino]-N'-hydroxyethanimidamide
CID 76927576
2-[2-(dimethylamino)ethyl-ethylamino]-N'-hydroxyethanimidamide
CID 76929176
N'-hydroxy-3-[3-(2-methoxyethoxy)propyl-propan-2-ylamino]propanimidamide
CID 103409985
2-[ethyl(3-ethylsulfanylpropyl)amino]-N'-hydroxyethanimidamide
CID 104863487
2-(dibutylamino)-N'-hydroxyethanimidamide
CID 74859795
2-[3-(2-methoxyethoxy)propyl-propylamino]acetic acid
CID 103410839
N'-hydroxy-2-[3-(2-methoxyethoxy)propyl-methylamino]propanimidamide
CID 103409990

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide?
The IUPAC name of 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide (CID 103409988) is 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide.
What is the SMILES notation for 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide?
The canonical SMILES for 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide is CCN(CCCOCCOC)CC(N)=NO.
What is the InChIKey of 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide?
The InChIKey is JAIXAQXKSRAFKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N3O3/c1-3-13(9-10(11)12-14)5-4-6-16-8-7-15-2/h14H,3-9H2,1-2H3,(H2,11,12).
What are the key properties of 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide?
2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide has a molecular weight of 233.31 g/mol, XLogP of 0.11, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[3-(2-methoxyethoxy)propyl]amino]-N'-hydroxyethanimidamide is sourced from PubChem (CID 103409988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).