iodoform;N-methylmethanamine

C3H8I3N — CID 90734058

IUPACiodoform;N-methylmethanamine
SMILESCNC.IC(I)I
InChIInChI=1S/C2H7N.CHI3/c1-3-2;2-1(3)4/h3H,1-2H3;1H
InChIKeyJYUOTQPVYWZTFI-UHFFFAOYSA-N
MW438.82 g/mol
LogP2.41
Rot. Bonds

About iodoform;N-methylmethanamine

iodoform;N-methylmethanamine (PubChem CID 90734058) has the molecular formula C3H8I3N and a molecular weight of 438.82 g/mol. Its IUPAC name is iodoform;N-methylmethanamine.

Molecular Properties

Compound Nameiodoform;N-methylmethanamine
PubChem CID90734058
Molecular FormulaC3H8I3N
Molecular Weight438.82 g/mol
Exact Mass438.78
IUPAC Nameiodoform;N-methylmethanamine
SMILESCNC.IC(I)I
InChIInChI=1S/C2H7N.CHI3/c1-3-2;2-1(3)4/h3H,1-2H3;1H
InChIKeyJYUOTQPVYWZTFI-UHFFFAOYSA-N
XLogP2.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.82
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze iodoform;N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of iodoform;N-methylmethanamine?
The IUPAC name of iodoform;N-methylmethanamine (CID 90734058) is iodoform;N-methylmethanamine.
What is the SMILES notation for iodoform;N-methylmethanamine?
The canonical SMILES for iodoform;N-methylmethanamine is CNC.IC(I)I.
What is the InChIKey of iodoform;N-methylmethanamine?
The InChIKey is JYUOTQPVYWZTFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N.CHI3/c1-3-2;2-1(3)4/h3H,1-2H3;1H.
What are the key properties of iodoform;N-methylmethanamine?
iodoform;N-methylmethanamine has a molecular weight of 438.82 g/mol, XLogP of 2.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for iodoform;N-methylmethanamine is sourced from PubChem (CID 90734058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).