3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide

C11H24N4O2 — CID 110942506

IUPAC3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide
SMILESCCN/C(=N\CC(C)(C)C(N)=O)NCCOC
InChIInChI=1S/C11H24N4O2/c1-5-13-10(14-6-7-17-4)15-8-11(2,3)9(12)16/h5-8H2,1-4H3,(H2,12,16)(H2,13,14,15)
InChIKeyHRRDKBMEWKUXFN-UHFFFAOYSA-N
MW244.34 g/mol
LogP-0.30
Rot. Bonds7

About 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide

3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide (PubChem CID 110942506) has the molecular formula C11H24N4O2 and a molecular weight of 244.34 g/mol. Its IUPAC name is 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide.

Molecular Properties

Compound Name3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide
PubChem CID110942506
Molecular FormulaC11H24N4O2
Molecular Weight244.34 g/mol
Exact Mass244.19
IUPAC Name3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide
SMILESCCN/C(=N\CC(C)(C)C(N)=O)NCCOC
InChIInChI=1S/C11H24N4O2/c1-5-13-10(14-6-7-17-4)15-8-11(2,3)9(12)16/h5-8H2,1-4H3,(H2,12,16)(H2,13,14,15)
InChIKeyHRRDKBMEWKUXFN-UHFFFAOYSA-N
XLogP-0.30
TPSA88.74 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 5-0.30
H-Bond Donors ≤ 53
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'}

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Related Compounds

3-[[ethylamino-(3-methoxypropylamino)methylidene]amino]-2,2-dimethylpropanamide;hydroiodide
CID 110976492
3-[bis(ethylamino)methylideneamino]-2,2-dimethylpropanamide
CID 110916054
3-[[ethylamino-[3-(2-methylpropoxy)propylamino]methylidene]amino]-2,2-dimethylpropanamide
CID 111400881
1-ethyl-3-(2-methoxyethyl)-2-(2-methoxy-2-methylpropyl)guanidine
CID 111606699
3-[[ethylamino-(2-methylsulfanylethylamino)methylidene]amino]-2,2-dimethylpropanamide;hydroiodide
CID 111344172
3-[[ethylamino-(prop-2-enylamino)methylidene]amino]-2,2-dimethylpropanamide
CID 110982887
3-[[(3-cyclopentylpropylamino)-(ethylamino)methylidene]amino]-2,2-dimethylpropanamide
CID 111947123
3-[[[2-(3,4-dimethoxyphenyl)ethylamino]-(ethylamino)methylidene]amino]-2,2-dimethylpropanamide
CID 111214297
3-[[ethylamino-(propan-2-ylamino)methylidene]amino]-2,2-dimethylpropanamide
CID 111124041
1-ethyl-2,3-bis(2-methoxyethyl)guanidine
CID 110940924
tert-butyl 2-[[ethylamino-(2-methoxyethylamino)methylidene]amino]acetate
CID 111544491
3-[[ethylamino-[2-(2-methoxyphenyl)ethylamino]methylidene]amino]-2,2-dimethylpropanamide;hydroiodide
CID 111339188

Frequently Asked Questions

What is the IUPAC name of 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide?
The IUPAC name of 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide (CID 110942506) is 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide.
What is the SMILES notation for 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide?
The canonical SMILES for 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide is CCN/C(=N\CC(C)(C)C(N)=O)NCCOC.
What is the InChIKey of 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide?
The InChIKey is HRRDKBMEWKUXFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4O2/c1-5-13-10(14-6-7-17-4)15-8-11(2,3)9(12)16/h5-8H2,1-4H3,(H2,12,16)(H2,13,14,15).
What are the key properties of 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide?
3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide has a molecular weight of 244.34 g/mol, XLogP of -0.30, 7 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[ethylamino-(2-methoxyethylamino)methylidene]amino]-2,2-dimethylpropanamide is sourced from PubChem (CID 110942506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).