2,2-dimethoxyethanimidamide;hydrochloride

C4H11ClN2O2 — CID 162421567

IUPAC2,2-dimethoxyethanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C(OC)OC
InChIInChI=1S/C4H10N2O2.ClH/c1-7-4(8-2)3(5)6;/h4H,1-2H3,(H3,5,6);1H
InChIKeyLJRPGJDNJOXUFV-UHFFFAOYSA-N
MW154.60 g/mol
LogP-0.04
Rot. Bonds3

About 2,2-dimethoxyethanimidamide;hydrochloride

2,2-dimethoxyethanimidamide;hydrochloride (PubChem CID 162421567) has the molecular formula C4H11ClN2O2 and a molecular weight of 154.60 g/mol. Its IUPAC name is 2,2-dimethoxyethanimidamide;hydrochloride.

Molecular Properties

Compound Name2,2-dimethoxyethanimidamide;hydrochloride
PubChem CID162421567
Molecular FormulaC4H11ClN2O2
Molecular Weight154.60 g/mol
Exact Mass154.05
IUPAC Name2,2-dimethoxyethanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C(OC)OC
InChIInChI=1S/C4H10N2O2.ClH/c1-7-4(8-2)3(5)6;/h4H,1-2H3,(H3,5,6);1H
InChIKeyLJRPGJDNJOXUFV-UHFFFAOYSA-N
XLogP-0.04
TPSA68.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.60
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2,2-Diethoxyethanimidamide hydrochloride
CID 13136495
2,2-Diethoxyethanimidamide
CID 4345614
2-(Methoxymethoxy)ethanimidamide hydrochloride
CID 75421025
(1-Amino-2,2-diethoxyethylidene)azanium chloride
CID 11367396
2-(Methoxymethoxy)acetamidine
CID 10534653
2-Hydroxy-2-methoxyethanimidamide
CID 87313491
N'-chloro-2,2-diethoxyethanimidamide
CID 89176144
2,2-Dimethoxyethanimidamide
CID 91755978
Sodium;2,2-diethoxyethanimidamide;chloride
CID 122460864
2-Ethoxy-2-methoxyethanimidamide
CID 151212730
N'-chloro-2,2-diethoxyethanimidamide
CID 173486946

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethoxyethanimidamide;hydrochloride?
The IUPAC name of 2,2-dimethoxyethanimidamide;hydrochloride (CID 162421567) is 2,2-dimethoxyethanimidamide;hydrochloride.
What is the SMILES notation for 2,2-dimethoxyethanimidamide;hydrochloride?
The canonical SMILES for 2,2-dimethoxyethanimidamide;hydrochloride is Cl.[H]/N=C(\N)C(OC)OC.
What is the InChIKey of 2,2-dimethoxyethanimidamide;hydrochloride?
The InChIKey is LJRPGJDNJOXUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O2.ClH/c1-7-4(8-2)3(5)6;/h4H,1-2H3,(H3,5,6);1H.
What are the key properties of 2,2-dimethoxyethanimidamide;hydrochloride?
2,2-dimethoxyethanimidamide;hydrochloride has a molecular weight of 154.60 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethoxyethanimidamide;hydrochloride is sourced from PubChem (CID 162421567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).