2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide

C11H23IN4O2 — CID 120661109

IUPAC2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide
SMILESCC(C)NC(=O)C/N=C(\N)N1CCOC(C)C1.I
InChIInChI=1S/C11H22N4O2.HI/c1-8(2)14-10(16)6-13-11(12)15-4-5-17-9(3)7-15;/h8-9H,4-7H2,1-3H3,(H2,12,13)(H,14,16);1H
InChIKeyYSIDRGNLDFLWGS-UHFFFAOYSA-N
MW370.24 g/mol
LogP0.16
Rot. Bonds3

About 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide

2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide (PubChem CID 120661109) has the molecular formula C11H23IN4O2 and a molecular weight of 370.24 g/mol. Its IUPAC name is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide.

Molecular Properties

Compound Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide
PubChem CID120661109
Molecular FormulaC11H23IN4O2
Molecular Weight370.24 g/mol
Exact Mass370.09
IUPAC Name2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide
SMILESCC(C)NC(=O)C/N=C(\N)N1CCOC(C)C1.I
InChIInChI=1S/C11H22N4O2.HI/c1-8(2)14-10(16)6-13-11(12)15-4-5-17-9(3)7-15;/h8-9H,4-7H2,1-3H3,(H2,12,13)(H,14,16);1H
InChIKeyYSIDRGNLDFLWGS-UHFFFAOYSA-N
XLogP0.16
TPSA79.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.24
LogP ≤ 50.16
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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-tert-butylacetamide;hydroiodide
CID 120661115
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-(2,2-difluoroethyl)acetamide
CID 120663326
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
(2S)-2-methyl-N-propan-2-ylmorpholine-4-carboxamide
CID 167135155
N'-(cyclobutylmethyl)-2-methylmorpholine-4-carboximidamide
CID 120661244
2-[[amino-(3-methylpiperidin-1-yl)methylidene]amino]-N-cyclopropylacetamide;hydroiodide
CID 111034680
2-methyl-N'-[(3-methylcyclohexyl)methyl]morpholine-4-carboximidamide;hydroiodide
CID 120661395
N'-[(1-methoxycyclopentyl)methyl]-2-methylmorpholine-4-carboximidamide
CID 122096742
4-[[[amino-(2-methylmorpholin-4-yl)methylidene]amino]methyl]oxane-4-carboxamide;hydroiodide
CID 120661307
1-[[[amino-(2-methylmorpholin-4-yl)methylidene]amino]methyl]-N,N-dimethylcyclopentane-1-carboxamide;hydroiodide
CID 120661703
3-[[amino(morpholin-4-yl)methylidene]amino]-N-propan-2-ylpropanamide;hydroiodide
CID 111043465

Frequently Asked Questions

What is the IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide?
The IUPAC name of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide (CID 120661109) is 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide.
What is the SMILES notation for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide?
The canonical SMILES for 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide is CC(C)NC(=O)C/N=C(\N)N1CCOC(C)C1.I.
What is the InChIKey of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide?
The InChIKey is YSIDRGNLDFLWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N4O2.HI/c1-8(2)14-10(16)6-13-11(12)15-4-5-17-9(3)7-15;/h8-9H,4-7H2,1-3H3,(H2,12,13)(H,14,16);1H.
What are the key properties of 2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide?
2-[[amino-(2-methylmorpholin-4-yl)methylidene]amino]-N-propan-2-ylacetamide;hydroiodide has a molecular weight of 370.24 g/mol, XLogP of 0.16, 3 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-propan-2-ylacetamide;hydroiodide is sourced from PubChem (CID 120661109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).