dichloromethane;N-methylethanamine

C4H11Cl2N — CID 158105373

IUPACdichloromethane;N-methylethanamine
SMILESCCNC.ClCCl
InChIInChI=1S/C3H9N.CH2Cl2/c1-3-4-2;2-1-3/h4H,3H2,1-2H3;1H2
InChIKeyFPTLYBJKVYNNNB-UHFFFAOYSA-N
MW144.04 g/mol
LogP1.65
Rot. Bonds1

About dichloromethane;N-methylethanamine

dichloromethane;N-methylethanamine (PubChem CID 158105373) has the molecular formula C4H11Cl2N and a molecular weight of 144.04 g/mol. Its IUPAC name is dichloromethane;N-methylethanamine.

Molecular Properties

Compound Namedichloromethane;N-methylethanamine
PubChem CID158105373
Molecular FormulaC4H11Cl2N
Molecular Weight144.04 g/mol
Exact Mass143.03
IUPAC Namedichloromethane;N-methylethanamine
SMILESCCNC.ClCCl
InChIInChI=1S/C3H9N.CH2Cl2/c1-3-4-2;2-1-3/h4H,3H2,1-2H3;1H2
InChIKeyFPTLYBJKVYNNNB-UHFFFAOYSA-N
XLogP1.65
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.04
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze dichloromethane;N-methylethanamine 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 dichloromethane;N-methylethanamine?
The IUPAC name of dichloromethane;N-methylethanamine (CID 158105373) is dichloromethane;N-methylethanamine.
What is the SMILES notation for dichloromethane;N-methylethanamine?
The canonical SMILES for dichloromethane;N-methylethanamine is CCNC.ClCCl.
What is the InChIKey of dichloromethane;N-methylethanamine?
The InChIKey is FPTLYBJKVYNNNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.CH2Cl2/c1-3-4-2;2-1-3/h4H,3H2,1-2H3;1H2.
What are the key properties of dichloromethane;N-methylethanamine?
dichloromethane;N-methylethanamine has a molecular weight of 144.04 g/mol, XLogP of 1.65, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dichloromethane;N-methylethanamine is sourced from PubChem (CID 158105373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).