2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide

C16H25N5O2 — CID 120661506

IUPAC2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESCC1CN(/C(N)=N/CC(=O)N(C)CCc2ccccn2)CCO1
InChIInChI=1S/C16H25N5O2/c1-13-12-21(9-10-23-13)16(17)19-11-15(22)20(2)8-6-14-5-3-4-7-18-14/h3-5,7,13H,6,8-12H2,1-2H3,(H2,17,19)
InChIKeyLZFPWHVKTIAMRP-UHFFFAOYSA-N
MW319.41 g/mol
LogP0.12
Rot. Bonds5

About 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide

2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (PubChem CID 120661506) has the molecular formula C16H25N5O2 and a molecular weight of 319.41 g/mol. Its IUPAC name is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
PubChem CID120661506
Molecular FormulaC16H25N5O2
Molecular Weight319.41 g/mol
Exact Mass319.20
IUPAC Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
SMILESCC1CN(/C(N)=N/CC(=O)N(C)CCc2ccccn2)CCO1
InChIInChI=1S/C16H25N5O2/c1-13-12-21(9-10-23-13)16(17)19-11-15(22)20(2)8-6-14-5-3-4-7-18-14/h3-5,7,13H,6,8-12H2,1-2H3,(H2,17,19)
InChIKeyLZFPWHVKTIAMRP-UHFFFAOYSA-N
XLogP0.12
TPSA84.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.41
LogP ≤ 50.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide 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

tert-butyl 4-[N'-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]carbamimidoyl]piperazine-1-carboxylate
CID 111095984
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-ethyl-N-methylacetamide;hydroiodide
CID 120662161
ethyl 4-[[N'-[2-[methyl(2-pyridin-2-ylethyl)amino]-2-oxoethyl]carbamimidoyl]amino]piperidine-1-carboxylate
CID 111095974
2-[[amino-(propan-2-ylamino)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide;hydroiodide
CID 111095959
2-[[amino-(butan-2-ylamino)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide;hydroiodide
CID 110935214
2-[[amino-(3-methylbutylamino)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 111095936
N'-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-methylmorpholine-4-carboximidamide
CID 120661382
2-methyl-N'-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethyl]morpholine-4-carboximidamide;hydroiodide
CID 120661235
2-[bis(ethylamino)methylideneamino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide;hydroiodide
CID 110935198
2-methyl-N'-[2-(2-methylphenyl)ethyl]morpholine-4-carboximidamide
CID 166222802
2-[[amino-(2-methoxyethylamino)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 110935205
2-[[ethylamino-[3-(4-methoxyphenyl)pyrrolidin-1-yl]methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide
CID 111732157

Frequently Asked Questions

What is the IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide (CID 120661506) is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide.
What is the SMILES notation for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The canonical SMILES for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide is CC1CN(/C(N)=N/CC(=O)N(C)CCc2ccccn2)CCO1.
What is the InChIKey of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
The InChIKey is LZFPWHVKTIAMRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N5O2/c1-13-12-21(9-10-23-13)16(17)19-11-15(22)20(2)8-6-14-5-3-4-7-18-14/h3-5,7,13H,6,8-12H2,1-2H3,(H2,17,19).
What are the key properties of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide?
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide has a molecular weight of 319.41 g/mol, XLogP of 0.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-methyl-N-(2-pyridin-2-ylethyl)acetamide is sourced from PubChem (CID 120661506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).