N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide

C8H18IN3 — CID 131039665

IUPACN-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
SMILESCCN/C(=N\C)N1CCCC1.I
InChIInChI=1S/C8H17N3.HI/c1-3-10-8(9-2)11-6-4-5-7-11;/h3-7H2,1-2H3,(H,9,10);1H
InChIKeyQYKMHZGWZOBSAW-UHFFFAOYSA-N
MW283.16 g/mol
LogP1.30
Rot. Bonds1

About N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide

N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide (PubChem CID 131039665) has the molecular formula C8H18IN3 and a molecular weight of 283.16 g/mol. Its IUPAC name is N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide.

Molecular Properties

Compound NameN-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
PubChem CID131039665
Molecular FormulaC8H18IN3
Molecular Weight283.16 g/mol
Exact Mass283.05
IUPAC NameN-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
SMILESCCN/C(=N\C)N1CCCC1.I
InChIInChI=1S/C8H17N3.HI/c1-3-10-8(9-2)11-6-4-5-7-11;/h3-7H2,1-2H3,(H,9,10);1H
InChIKeyQYKMHZGWZOBSAW-UHFFFAOYSA-N
XLogP1.30
TPSA27.63 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.16
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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'}

Analyze N-ethyl-N'-methylpyrrolidine-1-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-(2-bromoprop-2-enyl)-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
CID 119114555
N'-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-carboximidamide;hydroiodide
CID 110934488
N-ethyl-N',3-dimethyl-3-propylpiperidine-1-carboximidamide
CID 109490392
N'-methyl-N-(2-pyrazol-1-ylethyl)pyrrolidine-1-carboximidamide
CID 110934489
N-ethyl-N'-[(1-hydroxycyclobutyl)methyl]pyrrolidine-1-carboximidamide
CID 111546529
N'-methyl-N-(3,3,3-trifluoropropyl)pyrrolidine-1-carboximidamide
CID 111466142
N'-[2-(tert-butylamino)ethyl]-N-ethylpyrrolidine-1-carboximidamide
CID 111758730
N'-methyl-N-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidine-1-carboximidamide;hydroiodide
CID 110933532
N'-[2-[di(propan-2-yl)amino]ethyl]-N-ethylpyrrolidine-1-carboximidamide
CID 110955978
methyl 3-[[ethylamino(pyrrolidin-1-yl)methylidene]amino]-2-methylpropanoate;hydroiodide
CID 110956293
N-[2-[[ethylamino(pyrrolidin-1-yl)methylidene]amino]ethyl]-2,2-dimethylpropanamide;hydroiodide
CID 110956103
N-ethyl-N'-[2-[methyl(propan-2-yl)amino]ethyl]pyrrolidine-1-carboximidamide
CID 110956270

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide?
The IUPAC name of N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide (CID 131039665) is N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide.
What is the SMILES notation for N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide?
The canonical SMILES for N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide is CCN/C(=N\C)N1CCCC1.I.
What is the InChIKey of N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide?
The InChIKey is QYKMHZGWZOBSAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N3.HI/c1-3-10-8(9-2)11-6-4-5-7-11;/h3-7H2,1-2H3,(H,9,10);1H.
What are the key properties of N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide?
N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide has a molecular weight of 283.16 g/mol, XLogP of 1.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide is sourced from PubChem (CID 131039665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).