N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

C12H25IN4O — CID 120970896

IUPACN-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCCN1CCOCC1(C)C.I
InChIInChI=1S/C12H24N4O.HI/c1-12(2)10-17-9-8-16(12)7-5-14-11-13-4-6-15(11)3;/h4-10H2,1-3H3,(H,13,14);1H
InChIKeyILXJLHPSMIFXIR-UHFFFAOYSA-N
MW368.26 g/mol
LogP0.61
Rot. Bonds3

About N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide

N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (PubChem CID 120970896) has the molecular formula C12H25IN4O and a molecular weight of 368.26 g/mol. Its IUPAC name is N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.

Molecular Properties

Compound NameN-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
PubChem CID120970896
Molecular FormulaC12H25IN4O
Molecular Weight368.26 g/mol
Exact Mass368.11
IUPAC NameN-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
SMILESCN1CCN=C1NCCN1CCOCC1(C)C.I
InChIInChI=1S/C12H24N4O.HI/c1-12(2)10-17-9-8-16(12)7-5-14-11-13-4-6-15(11)3;/h4-10H2,1-3H3,(H,13,14);1H
InChIKeyILXJLHPSMIFXIR-UHFFFAOYSA-N
XLogP0.61
TPSA40.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.26
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;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

1-methyl-N-[2-(oxan-4-yl)ethyl]-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120971020
N-[(4-ethyloxan-4-yl)methyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide
CID 120970990
N-[2-(azepan-1-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine
CID 120969889
N-(3-fluoropropyl)-1-methyl-4,5-dihydroimidazol-2-amine
CID 126979416
4-[(1-methyl-4,5-dihydroimidazol-2-yl)amino]butanenitrile
CID 130701760
2-amino-N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-2-methylpropanamide
CID 119876424
1-methyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]-4,5-dihydroimidazol-2-amine
CID 120972593
3-(3,3-dimethylmorpholin-4-yl)-N-propan-2-ylpropan-1-amine
CID 61430784
2-(3,3-dimethylmorpholin-4-yl)-N-(2-ethoxyethyl)ethanamine
CID 62558951
N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-4-methylcyclohexan-1-amine
CID 62557218
2-amino-N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]acetamide
CID 119876464
3-(3,3-dimethylmorpholin-4-yl)propan-1-ol
CID 54352391

Frequently Asked Questions

What is the IUPAC name of N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The IUPAC name of N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide (CID 120970896) is N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide.
What is the SMILES notation for N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The canonical SMILES for N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is CN1CCN=C1NCCN1CCOCC1(C)C.I.
What is the InChIKey of N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
The InChIKey is ILXJLHPSMIFXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4O.HI/c1-12(2)10-17-9-8-16(12)7-5-14-11-13-4-6-15(11)3;/h4-10H2,1-3H3,(H,13,14);1H.
What are the key properties of N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide?
N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide has a molecular weight of 368.26 g/mol, XLogP of 0.61, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3,3-dimethylmorpholin-4-yl)ethyl]-1-methyl-4,5-dihydroimidazol-2-amine;hydroiodide is sourced from PubChem (CID 120970896), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).