2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide

C10H18F2N4O2 — CID 120663326

IUPAC2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide
SMILESCC1CN(/C(N)=N/CC(=O)NCC(F)F)CCO1
InChIInChI=1S/C10H18F2N4O2/c1-7-6-16(2-3-18-7)10(13)15-5-9(17)14-4-8(11)12/h7-8H,2-6H2,1H3,(H2,13,15)(H,14,17)
InChIKeyZWEOCEAZXHJCRW-UHFFFAOYSA-N
MW264.28 g/mol
LogP-0.60
Rot. Bonds4

About 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide

2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide (PubChem CID 120663326) has the molecular formula C10H18F2N4O2 and a molecular weight of 264.28 g/mol. Its IUPAC name is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide.

Molecular Properties

Compound Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide
PubChem CID120663326
Molecular FormulaC10H18F2N4O2
Molecular Weight264.28 g/mol
Exact Mass264.14
IUPAC Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide
SMILESCC1CN(/C(N)=N/CC(=O)NCC(F)F)CCO1
InChIInChI=1S/C10H18F2N4O2/c1-7-6-16(2-3-18-7)10(13)15-5-9(17)14-4-8(11)12/h7-8H,2-6H2,1H3,(H2,13,15)(H,14,17)
InChIKeyZWEOCEAZXHJCRW-UHFFFAOYSA-N
XLogP-0.60
TPSA79.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.28
LogP ≤ 5-0.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide
CID 120661109
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-tert-butylacetamide;hydroiodide
CID 120661115
2-[[amino(morpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide;hydroiodide
CID 120663315
2-methyl-N'-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboximidamide;hydroiodide
CID 120661161
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-ethyl-N-methylacetamide;hydroiodide
CID 120662161
N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide
CID 120661244
N'-[2-(tert-butylamino)ethyl]-2-methylmorpholine-4-carboximidamide
CID 120661618
N'-(2-methoxy-3,3-dimethylbutyl)-2-methylmorpholine-4-carboximidamide
CID 120661582
4-[[[amino-(2-methylmorpholin-4-yl)methylidene]amino]methyl]oxane-4-carboxamide;hydroiodide
CID 120661307
2-methyl-N'-[(2-methyloxan-4-yl)methyl]morpholine-4-carboximidamide
CID 120662006
N'-(2-methoxy-2-methylpropyl)-2-methylmorpholine-4-carboximidamide
CID 120661722
2-methylmorpholine-4-carboperoxoic acid
CID 175134730

Frequently Asked Questions

What is the IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide?
The IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide (CID 120663326) is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide.
What is the SMILES notation for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide?
The canonical SMILES for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide is CC1CN(/C(N)=N/CC(=O)NCC(F)F)CCO1.
What is the InChIKey of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide?
The InChIKey is ZWEOCEAZXHJCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N4O2/c1-7-6-16(2-3-18-7)10(13)15-5-9(17)14-4-8(11)12/h7-8H,2-6H2,1H3,(H2,13,15)(H,14,17).
What are the key properties of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide?
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide has a molecular weight of 264.28 g/mol, XLogP of -0.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide is sourced from PubChem (CID 120663326), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).