2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide

C10H23IN4O2 — CID 111037025

IUPAC2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide
SMILESCOCCNC(=O)CN=C(N(C)C)N(C)C.I
InChIInChI=1S/C10H22N4O2.HI/c1-13(2)10(14(3)4)12-8-9(15)11-6-7-16-5;/h6-8H2,1-5H3,(H,11,15);1H
InChIKeyNTHPPHDHMCDNHY-UHFFFAOYSA-N
MW358.22 g/mol
LogP-0.15
Rot. Bonds5

About 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide

2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide (PubChem CID 111037025) has the molecular formula C10H23IN4O2 and a molecular weight of 358.22 g/mol. Its IUPAC name is 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide.

Molecular Properties

Compound Name2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide
PubChem CID111037025
Molecular FormulaC10H23IN4O2
Molecular Weight358.22 g/mol
Exact Mass358.09
IUPAC Name2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide
SMILESCOCCNC(=O)CN=C(N(C)C)N(C)C.I
InChIInChI=1S/C10H22N4O2.HI/c1-13(2)10(14(3)4)12-8-9(15)11-6-7-16-5;/h6-8H2,1-5H3,(H,11,15);1H
InChIKeyNTHPPHDHMCDNHY-UHFFFAOYSA-N
XLogP-0.15
TPSA57.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.22
LogP ≤ 5-0.15
H-Bond Donors ≤ 51
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': 'iodine', 'substructure': 'N/A'}

Analyze 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide 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

2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111037001
2-[[amino(propylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111036987
2-[bis(dimethylamino)methylideneamino]-N-(2-phenylethyl)acetamide;hydroiodide
CID 111090964
2-[[(tert-butylamino)-(ethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 110966967
2-[[2-(dimethylamino)-2-oxoethyl]amino]-N-(2-methoxyethyl)acetamide
CID 60697905
2-hydroxy-N-(2-methoxyethyl)acetamide
CID 19987818
2-[[ethylamino-(pentylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111130397
2-[[ethylamino-(2-methylpropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111180944
2-[[ethylamino-[2-[3-methoxypropyl(methyl)amino]ethylamino]methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111652856
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
2-[[ethylamino-(3-methylbutylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 110979138
2-[[amino-(3-ethoxypropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111037013

Frequently Asked Questions

What is the IUPAC name of 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The IUPAC name of 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide (CID 111037025) is 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide.
What is the SMILES notation for 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The canonical SMILES for 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide is COCCNC(=O)CN=C(N(C)C)N(C)C.I.
What is the InChIKey of 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The InChIKey is NTHPPHDHMCDNHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2.HI/c1-13(2)10(14(3)4)12-8-9(15)11-6-7-16-5;/h6-8H2,1-5H3,(H,11,15);1H.
What are the key properties of 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide?
2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide has a molecular weight of 358.22 g/mol, XLogP of -0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide is sourced from PubChem (CID 111037025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).