N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide

C12H21IN4O3 — CID 111821880

IUPACN'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\CCN1C(=O)CCCC1=O)N1CCOCC1
InChIInChI=1S/C12H20N4O3.HI/c13-12(15-6-8-19-9-7-15)14-4-5-16-10(17)2-1-3-11(16)18;/h1-9H2,(H2,13,14);1H
InChIKeyWHMSORLDKGNLOT-UHFFFAOYSA-N
MW396.23 g/mol
LogP-0.21
Rot. Bonds3

About N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide

N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide (PubChem CID 111821880) has the molecular formula C12H21IN4O3 and a molecular weight of 396.23 g/mol. Its IUPAC name is N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide
PubChem CID111821880
Molecular FormulaC12H21IN4O3
Molecular Weight396.23 g/mol
Exact Mass396.07
IUPAC NameN'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide
SMILESI.N/C(=N\CCN1C(=O)CCCC1=O)N1CCOCC1
InChIInChI=1S/C12H20N4O3.HI/c13-12(15-6-8-19-9-7-15)14-4-5-16-10(17)2-1-3-11(16)18;/h1-9H2,(H2,13,14);1H
InChIKeyWHMSORLDKGNLOT-UHFFFAOYSA-N
XLogP-0.21
TPSA88.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.23
LogP ≤ 5-0.21
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'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide 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

N'-(4-pyrrolidin-1-ylbutyl)morpholine-4-carboximidamide;hydroiodide
CID 111059740
N'-[2-(3,4-dihydro-1H-isoquinolin-2-yl)ethyl]morpholine-4-carboximidamide;hydroiodide
CID 111055482
N'-(2-ethoxyethyl)morpholine-4-carboximidamide;hydroiodide
CID 111045505
N'-(2-morpholin-4-ylethyl)thiomorpholine-4-carboximidamide;hydroiodide
CID 111024484
N'-[3-(3-oxo-1,4-benzoxazin-4-yl)propyl]morpholine-4-carboximidamide
CID 111818998
N'-(2-oxo-2-pyrrolidin-1-ylethyl)morpholine-4-carboximidamide;hydroiodide
CID 111040241
N'-(2-ethylsulfonylethyl)morpholine-4-carboximidamide
CID 111100374
3-[[amino(morpholin-4-yl)methylidene]amino]-N-propan-2-ylpropanamide;hydroiodide
CID 111043465
N'-[2-(3-methylpiperidin-1-yl)ethyl]morpholine-4-carboximidamide
CID 111056830
N'-[2-(diethylamino)ethyl]morpholine-4-carboximidamide;hydroiodide
CID 111022667
N'-(2-phenylsulfanylethyl)morpholine-4-carboximidamide
CID 111033052
N'-[4-(4-ethylpiperazin-1-yl)butyl]morpholine-4-carboximidamide;hydroiodide
CID 111060330

Frequently Asked Questions

What is the IUPAC name of N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide?
The IUPAC name of N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide (CID 111821880) is N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide.
What is the SMILES notation for N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide?
The canonical SMILES for N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide is I.N/C(=N\CCN1C(=O)CCCC1=O)N1CCOCC1.
What is the InChIKey of N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide?
The InChIKey is WHMSORLDKGNLOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3.HI/c13-12(15-6-8-19-9-7-15)14-4-5-16-10(17)2-1-3-11(16)18;/h1-9H2,(H2,13,14);1H.
What are the key properties of N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide?
N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide has a molecular weight of 396.23 g/mol, XLogP of -0.21, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[2-(2,6-dioxopiperidin-1-yl)ethyl]morpholine-4-carboximidamide;hydroiodide is sourced from PubChem (CID 111821880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).