2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide

C10H23IN4O2 — CID 111037001

IUPAC2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
SMILESCCN(CC)/C(N)=N/CC(=O)NCCOC.I
InChIInChI=1S/C10H22N4O2.HI/c1-4-14(5-2)10(11)13-8-9(15)12-6-7-16-3;/h4-8H2,1-3H3,(H2,11,13)(H,12,15);1H
InChIKeyBMLBZHZSZVPXFG-UHFFFAOYSA-N
MW358.22 g/mol
LogP0.02
Rot. Bonds7

About 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide

2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide (PubChem CID 111037001) has the molecular formula C10H23IN4O2 and a molecular weight of 358.22 g/mol. Its IUPAC name is 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide.

Molecular Properties

Compound Name2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
PubChem CID111037001
Molecular FormulaC10H23IN4O2
Molecular Weight358.22 g/mol
Exact Mass358.09
IUPAC Name2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
SMILESCCN(CC)/C(N)=N/CC(=O)NCCOC.I
InChIInChI=1S/C10H22N4O2.HI/c1-4-14(5-2)10(11)13-8-9(15)12-6-7-16-3;/h4-8H2,1-3H3,(H2,11,13)(H,12,15);1H
InChIKeyBMLBZHZSZVPXFG-UHFFFAOYSA-N
XLogP0.02
TPSA79.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.22
LogP ≤ 50.02
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': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-[[amino(propylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111036987
2-[bis(dimethylamino)methylideneamino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111037025
2-[[amino-(3-ethoxypropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 111037013
3-(diethylcarbamoylamino)-N-(2-methoxyethyl)propanamide
CID 113226661
2-[[amino-(3-ethoxypropylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111037014
2-[[amino-(1-methoxypropan-2-ylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide
CID 111037070
2-[[(tert-butylamino)-(ethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 110966967
3-(1-aminoethylideneamino)-N-(2-methoxyethyl)propanamide
CID 115612361
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-[[amino(diethylamino)methylidene]amino]-N-(4-fluorophenyl)acetamide;hydroiodide
CID 111089290
2-[[ethylamino-(3-methylbutylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide
CID 110979138

Frequently Asked Questions

What is the IUPAC name of 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The IUPAC name of 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide (CID 111037001) is 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide.
What is the SMILES notation for 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The canonical SMILES for 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide is CCN(CC)/C(N)=N/CC(=O)NCCOC.I.
What is the InChIKey of 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide?
The InChIKey is BMLBZHZSZVPXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N4O2.HI/c1-4-14(5-2)10(11)13-8-9(15)12-6-7-16-3;/h4-8H2,1-3H3,(H2,11,13)(H,12,15);1H.
What are the key properties of 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide?
2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide has a molecular weight of 358.22 g/mol, XLogP of 0.02, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino(diethylamino)methylidene]amino]-N-(2-methoxyethyl)acetamide;hydroiodide is sourced from PubChem (CID 111037001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).