N,N-dimethylformamide;molecular chlorine

C3H7Cl2NO — CID 86751989

IUPACN,N-dimethylformamide;molecular chlorine
SMILESCN(C)C=O.ClCl
InChIInChI=1S/C3H7NO.Cl2/c1-4(2)3-5;1-2/h3H,1-2H3;
InChIKeyAJBKCWVGNULODF-UHFFFAOYSA-N
MW144.00 g/mol
LogP1.08
Rot. Bonds1

About N,N-dimethylformamide;molecular chlorine

N,N-dimethylformamide;molecular chlorine (PubChem CID 86751989) has the molecular formula C3H7Cl2NO and a molecular weight of 144.00 g/mol. Its IUPAC name is N,N-dimethylformamide;molecular chlorine.

Molecular Properties

Compound NameN,N-dimethylformamide;molecular chlorine
PubChem CID86751989
Molecular FormulaC3H7Cl2NO
Molecular Weight144.00 g/mol
Exact Mass142.99
IUPAC NameN,N-dimethylformamide;molecular chlorine
SMILESCN(C)C=O.ClCl
InChIInChI=1S/C3H7NO.Cl2/c1-4(2)3-5;1-2/h3H,1-2H3;
InChIKeyAJBKCWVGNULODF-UHFFFAOYSA-N
XLogP1.08
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.00
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-dimethylformamide;molecular chlorine 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 N,N-dimethylformamide;molecular chlorine?
The IUPAC name of N,N-dimethylformamide;molecular chlorine (CID 86751989) is N,N-dimethylformamide;molecular chlorine.
What is the SMILES notation for N,N-dimethylformamide;molecular chlorine?
The canonical SMILES for N,N-dimethylformamide;molecular chlorine is CN(C)C=O.ClCl.
What is the InChIKey of N,N-dimethylformamide;molecular chlorine?
The InChIKey is AJBKCWVGNULODF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.Cl2/c1-4(2)3-5;1-2/h3H,1-2H3;.
What are the key properties of N,N-dimethylformamide;molecular chlorine?
N,N-dimethylformamide;molecular chlorine has a molecular weight of 144.00 g/mol, XLogP of 1.08, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethylformamide;molecular chlorine is sourced from PubChem (CID 86751989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).