chloroform;N,N-dimethylmethanamine

C4H10Cl3N — CID 19983331

IUPACchloroform;N,N-dimethylmethanamine
SMILESCN(C)C.ClC(Cl)Cl
InChIInChI=1S/C3H9N.CHCl3/c1-4(2)3;2-1(3)4/h1-3H3;1H
InChIKeyLUEKTZMAXBKUJZ-UHFFFAOYSA-N
MW178.49 g/mol
LogP2.16
Rot. Bonds

About chloroform;N,N-dimethylmethanamine

chloroform;N,N-dimethylmethanamine (PubChem CID 19983331) has the molecular formula C4H10Cl3N and a molecular weight of 178.49 g/mol. Its IUPAC name is chloroform;N,N-dimethylmethanamine.

Molecular Properties

Compound Namechloroform;N,N-dimethylmethanamine
PubChem CID19983331
Molecular FormulaC4H10Cl3N
Molecular Weight178.49 g/mol
Exact Mass176.99
IUPAC Namechloroform;N,N-dimethylmethanamine
SMILESCN(C)C.ClC(Cl)Cl
InChIInChI=1S/C3H9N.CHCl3/c1-4(2)3;2-1(3)4/h1-3H3;1H
InChIKeyLUEKTZMAXBKUJZ-UHFFFAOYSA-N
XLogP2.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.49
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of chloroform;N,N-dimethylmethanamine?
The IUPAC name of chloroform;N,N-dimethylmethanamine (CID 19983331) is chloroform;N,N-dimethylmethanamine.
What is the SMILES notation for chloroform;N,N-dimethylmethanamine?
The canonical SMILES for chloroform;N,N-dimethylmethanamine is CN(C)C.ClC(Cl)Cl.
What is the InChIKey of chloroform;N,N-dimethylmethanamine?
The InChIKey is LUEKTZMAXBKUJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.CHCl3/c1-4(2)3;2-1(3)4/h1-3H3;1H.
What are the key properties of chloroform;N,N-dimethylmethanamine?
chloroform;N,N-dimethylmethanamine has a molecular weight of 178.49 g/mol, XLogP of 2.16, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloroform;N,N-dimethylmethanamine is sourced from PubChem (CID 19983331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).