N-methylpyrrolidin-2-imine;hydroiodide

C5H11IN2 — CID 136609989

IUPACN-methylpyrrolidin-2-imine;hydroiodide
SMILESC/N=C1\CCCN1.I
InChIInChI=1S/C5H10N2.HI/c1-6-5-3-2-4-7-5;/h2-4H2,1H3,(H,6,7);1H
InChIKeyPPRURERHHWSMOO-UHFFFAOYSA-N
MW226.06 g/mol
LogP1.02
Rot. Bonds

About N-methylpyrrolidin-2-imine;hydroiodide

N-methylpyrrolidin-2-imine;hydroiodide (PubChem CID 136609989) has the molecular formula C5H11IN2 and a molecular weight of 226.06 g/mol. Its IUPAC name is N-methylpyrrolidin-2-imine;hydroiodide.

Molecular Properties

Compound NameN-methylpyrrolidin-2-imine;hydroiodide
PubChem CID136609989
Molecular FormulaC5H11IN2
Molecular Weight226.06 g/mol
Exact Mass226.00
IUPAC NameN-methylpyrrolidin-2-imine;hydroiodide
SMILESC/N=C1\CCCN1.I
InChIInChI=1S/C5H10N2.HI/c1-6-5-3-2-4-7-5;/h2-4H2,1H3,(H,6,7);1H
InChIKeyPPRURERHHWSMOO-UHFFFAOYSA-N
XLogP1.02
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.06
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-methylpyrrolidin-2-imine;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

2-Imidazoline, 2-ethyl-
CID 13590
2-Imidazoline, 2-propyl-
CID 27291
N-methyl-3,4-dihydro-2H-pyrrol-5-amine hydrochloride
CID 136277051
(4,5-Dihydro-3H-pyrrol-2-yl)-methyl-amine
CID 135569018
2-Methyl-4,5,6,7-tetrahydro-1H-1,3-diazepine
CID 544286
N,N'-dibutylpropanimidamide
CID 86103188
2-(b-Aminoethylimino)-pyrrolidine
CID 66490513
N-(2-fluoroethyl)-3,4-dihydro-2H-pyrrol-5-amine
CID 133679897
N-butyl-N'-methylethanimidamide
CID 13734712
2-Propyl-1,4,5,6-tetrahydropyrimidine
CID 20202171
N-butyl-3,4-dihydro-2H-pyrrol-5-amine
CID 21050660
N,N'-diethylpropanimidamide
CID 53964693

Frequently Asked Questions

What is the IUPAC name of N-methylpyrrolidin-2-imine;hydroiodide?
The IUPAC name of N-methylpyrrolidin-2-imine;hydroiodide (CID 136609989) is N-methylpyrrolidin-2-imine;hydroiodide.
What is the SMILES notation for N-methylpyrrolidin-2-imine;hydroiodide?
The canonical SMILES for N-methylpyrrolidin-2-imine;hydroiodide is C/N=C1\CCCN1.I.
What is the InChIKey of N-methylpyrrolidin-2-imine;hydroiodide?
The InChIKey is PPRURERHHWSMOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2.HI/c1-6-5-3-2-4-7-5;/h2-4H2,1H3,(H,6,7);1H.
What are the key properties of N-methylpyrrolidin-2-imine;hydroiodide?
N-methylpyrrolidin-2-imine;hydroiodide has a molecular weight of 226.06 g/mol, XLogP of 1.02, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylpyrrolidin-2-imine;hydroiodide is sourced from PubChem (CID 136609989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).